SCHEMBL21504863

SCHEMBL21504863

C=C/C=C\C(=C/C)S(=O)(=O)Nc1ccc(C(N)=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ ALDH1A1 P00352 4/20 0.44
▸ KDM4E B2RXH2 3/20 0.40
▸ POLB P06746 1/20 0.40
▸ BRD4 O60885 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ CA2 P00918 2/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ HTT P42858 1/20 0.36
▸ CA1 P00915 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ CHUK O15111 1/20 0.35
▸ INSR P06213 1/20 0.35
▸ MAPK8 P45983 1/20 0.35
▸ CAMKK2 Q96RR4 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23797104 0.88 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1KDM4EPOLBBRD4
SCHEMBL18898459 0.86 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1KDM4EPOLBBRD4
SCHEMBL22519836 0.84 EPHX2 (0.37) SMN1; SMN2ALDH1A1KDM4EL3MBTL1CA2
SCHEMBL23958391 0.83 KEAP1 (0.43) ALDH1A1BRD4CA2MEN1KMT2A
SCHEMBL24311856 0.83 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1KDM4EPOLBBRD4
SCHEMBL20636072 0.77 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1KDM4EPOLBBRD4
SCHEMBL25489239 0.76 KDM4E (0.49) SMN1; SMN2ALDH1A1KDM4EPOLBL3MBTL1
SCHEMBL22844063 0.72 CA2 (0.37) SMN1; SMN2ALDH1A1KDM4EPOLBL3MBTL1
SCHEMBL2026762 0.72 HPGD (0.57) SMN1; SMN2ALDH1A1KDM4ECA2HTT
SCHEMBL18456642 0.71 CA2 (0.42) SMN1; SMN2ALDH1A1POLBBRD4L3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303549-A1 SUBSTITUTED HETEROARYLOXYPYRIDINES, THE SALTS THEREOF AND THEIR USE AS HERBICIDAL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2023-09-28 — — US disclosed
US-20220177428-A1 SPECIFICALLY SUBSTITUTED 3-(2-ALKOXY-6-ALKYL-4-PROPINYLPHENYL)-3-PYRROLIN-2-ONES AND THEIR USE AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2022-06-09 — — US disclosed
US-20220169618-A1 SUBSTITUTED 2-HETEROARYLAMINOBENZENES AND THE SALTS THEREOF AND THEIR USE AS HERBICIDAL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2022-06-02 — — US disclosed
US-11274083-B2 Substituted thiophenyl uracils, salts thereof and the use thereof as herbicidal agents SYNGENTA CROP PROTECTION AG (CH) 2022-03-15 — — US disclosed
US-20220056040-A1 NOVEL 3-(2-BROMO-4-ALKYNYL-6-ALKOXYPHENYL)-3-PYRROLIN-2-ONES AND THEIR USE AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2022-02-24 — — US disclosed
US-11191265-B2 Method of reducing crop damage BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2021-12-07 — — US disclosed
US-20210323950-A1 HERBICIDALLY ACTIVE BICYCLIC BENZOYLPYRAZOLES BAYER AG (DE) 2021-10-21 — — US disclosed
US-20210317089-A1 HERBICIDALLY ACTIVE SUBSTITUTED PHENYLPYRIMIDINES BAYER AKTIENGESELLSCHAFT (DE) 2021-10-14 — — US disclosed
US-20210307322-A1 CONTROLLED RELEASE FORMULATIONS WITH LIGNIN FOR AGROCHEMICALS DSM IP ASSETS B.V. (NL) 2021-10-07 — — US disclosed
US-20210289777-A1 METHOD OF REDUCING CROP DAMAGE FMC CORPORATION 2021-09-23 — — US disclosed
US-20200404907-A1 METHOD OF REDUCING CROP DAMAGE BAYER AKTIENGESELLSCHAFT (DE) 2020-12-31 — — US disclosed
US-20200390100-A1 SUBSTITUTED N-HETEROCYCLYL- AND N-HETEROARYL-TETRAHYDROPYRIMIDINONES AND THE SALTS THEREOF, AND THE USE OF SAME AS HERBICIDAL ACTIVE SUBSTANCES BAYER AG (DE) 2020-12-17 — — US disclosed
US-10863742-B2 Herbicide combinations BAYER AKTIENGESELLSCHAFT (DE) 2020-12-15 — — US disclosed
US-20200369630-A1 HERBICIDALLY ACTIVE 3-PHENYL-5-TRIFLUOROMETHYLISOXAZOLINE-5-CARBOXAMIDES OF CYCLOPENTYLCARBOXYLIC ACIDS AND ESTERS BAYER AKTIENGESELLSCHAFT (DE) 2020-11-26 — — US disclosed
US-20200196601-A1 HERBICIDE SAFENER COMPOSITIONS CONTAINING QUINAZOLINEDIONE-6CARBONYL DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-06-25 — — US disclosed
US-20200187499-A1 SUBSTITUTED BENZYL-4-AMINOPICOLINIC ESTERS AND PYRIMIDINO-4-CARBOXYLIC ESTERS, METHODS FOR THE PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 2020-06-18 — — US disclosed
US-20200172491-A1 SUBSTITUTED 5-(HET-)ARYLPYRAZOLAMIDES AND SALTS THEREOF AND THEIR USE AS HERBICIDAL ACTIVE SUBSTANCES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-06-04 — — US disclosed
US-20200029565-A1 2-AMINO-5-OXYALKYL-PYRIMIDINE DERIVATIVES AND THEIR USE FOR CONTROLLING UNDESIRED PLANT GROWTH BAYER AKTIENGESELLSCHAFT (DE) 2020-01-30 — — US disclosed
US-20190330192-A1 SUBSTITUTED AZOLYLPYRROLONES AND AZOLYLHYDANTOINS AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2019-10-31 — — US disclosed
US-20190320656-A1 HERBICIDE COMBINATIONS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-10-24 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (20 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210317089-A1 HERBICIDALLY ACTIVE SUBSTITUTED PHENYLPYRIMIDINES DDT, DPYD, GSTP1 SMN1; SMN2 3186/4885ALDH1A1 75/4885KDM4E 1751/4885
US-20200390100-A1 SUBSTITUTED N-HETEROCYCLYL- AND N-HETEROARYL-TETRAHYDROPYRIMIDINONES AND THE SALTS THEREOF, AND THE USE OF SAME AS HERBICIDAL ACTIVE SUBSTANCES DDT, NOTUM, AGPS SMN1; SMN2 4626/4885ALDH1A1 201/4885KDM4E 1416/4885
US-11274083-B2 Substituted thiophenyl uracils, salts thereof and the use thereof as herbicidal agents UNG, TYMP, TYMS SMN1; SMN2 4822/4885ALDH1A1 133/4885KDM4E 1634/4885
US-20220177428-A1 SPECIFICALLY SUBSTITUTED 3-(2-ALKOXY-6-ALKYL-4-PROPINYLPHENYL)-3-PYRROLIN-2-ONES AND THEIR USE AS HERBICIDES DDT, AGPS, HPD SMN1; SMN2 4731/4885ALDH1A1 120/4885KDM4E 804/4885
US-20200172491-A1 SUBSTITUTED 5-(HET-)ARYLPYRAZOLAMIDES AND SALTS THEREOF AND THEIR USE AS HERBICIDAL ACTIVE SUBSTANCES CYP4Z1, CYP3A5, CYP4X1 SMN1; SMN2 4861/4885ALDH1A1 570/4885KDM4E 778/4885
US-20220056040-A1 NOVEL 3-(2-BROMO-4-ALKYNYL-6-ALKOXYPHENYL)-3-PYRROLIN-2-ONES AND THEIR USE AS HERBICIDES DDT, HPD, AGPS SMN1; SMN2 4733/4885ALDH1A1 131/4885KDM4E 1520/4885
US-20210323950-A1 HERBICIDALLY ACTIVE BICYCLIC BENZOYLPYRAZOLES CBR3, CBR1, RTN3 SMN1; SMN2 2516/4885ALDH1A1 338/4885KDM4E 3945/4885
US-20200404907-A1 METHOD OF REDUCING CROP DAMAGE DDT, GAP43, GSS SMN1; SMN2 2867/4885ALDH1A1 1990/4885KDM4E 3052/4885
US-20200029565-A1 2-AMINO-5-OXYALKYL-PYRIMIDINE DERIVATIVES AND THEIR USE FOR CONTROLLING UNDESIRED PLANT GROWTH PFAS, ODC1, GART SMN1; SMN2 4116/4885ALDH1A1 1679/4885KDM4E 1418/4885
US-11191265-B2 Method of reducing crop damage DDT, GAP43, GSS SMN1; SMN2 2867/4885ALDH1A1 1990/4885KDM4E 3052/4885
US-20210307322-A1 CONTROLLED RELEASE FORMULATIONS WITH LIGNIN FOR AGROCHEMICALS LCT, LSS, PGLS SMN1; SMN2 3239/4885ALDH1A1 396/4885KDM4E 732/4885
US-10863742-B2 Herbicide combinations DDT, MTHFD2, DHFR SMN1; SMN2 4579/4885ALDH1A1 663/4885KDM4E 1269/4885
US-20200187499-A1 SUBSTITUTED BENZYL-4-AMINOPICOLINIC ESTERS AND PYRIMIDINO-4-CARBOXYLIC ESTERS, METHODS FOR THE PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS CBR3, PAH, DDC SMN1; SMN2 4701/4885ALDH1A1 527/4885KDM4E 300/4885
US-20220169618-A1 SUBSTITUTED 2-HETEROARYLAMINOBENZENES AND THE SALTS THEREOF AND THEIR USE AS HERBICIDAL AGENTS GUSB, DDT, GLB1 SMN1; SMN2 4821/4885ALDH1A1 590/4885KDM4E 488/4885
US-20190320656-A1 HERBICIDE COMBINATIONS DDT, MTHFD2, DHFR SMN1; SMN2 4579/4885ALDH1A1 663/4885KDM4E 1269/4885
US-20200369630-A1 HERBICIDALLY ACTIVE 3-PHENYL-5-TRIFLUOROMETHYLISOXAZOLINE-5-CARBOXAMIDES OF CYCLOPENTYLCARBOXYLIC ACIDS AND ESTERS AADAC, DDT, PRDX5 SMN1; SMN2 3764/4885ALDH1A1 216/4885KDM4E 960/4885
US-20210289777-A1 METHOD OF REDUCING CROP DAMAGE DDT, GAP43, GSS SMN1; SMN2 2867/4885ALDH1A1 1990/4885KDM4E 3052/4885
US-20230303549-A1 SUBSTITUTED HETEROARYLOXYPYRIDINES, THE SALTS THEREOF AND THEIR USE AS HERBICIDAL AGENTS DDT, AGPS, GMDS SMN1; SMN2 4854/4885ALDH1A1 601/4885KDM4E 1489/4885
US-20200196601-A1 HERBICIDE SAFENER COMPOSITIONS CONTAINING QUINAZOLINEDIONE-6CARBONYL DERIVATIVES CYP2F1, CYP2W1, CYP4F12 SMN1; SMN2 3629/4885ALDH1A1 447/4885KDM4E 1670/4885
US-20190330192-A1 SUBSTITUTED AZOLYLPYRROLONES AND AZOLYLHYDANTOINS AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES AGPS, AASDHPPT, HPD SMN1; SMN2 4853/4885ALDH1A1 215/4885KDM4E 893/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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