Sugi Predict

Sugi Predict / Compounds / SCHEMBL44667

SCHEMBL44667

SCHEMBL44667

O=C1C2=C(CCCC2)C(=O)N1c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ MGLL Q99685 1/20 0.46
▸ ALOX15 P16050 3/20 0.46
▸ HPGD P15428 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ TSHR P16473 2/20 0.46
▸ MAPT P10636 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ GAA P10253 2/20 0.45
▸ ALOX5 P09917 1/20 0.44
▸ PKM P14618 1/20 0.43
▸ TLR9 Q9NR96 1/20 0.43

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
SCHEMBL8593150 0.81 MEN1 (0.38) ALDH1A1NPSR1KDM4ELMNAMEN1
SCHEMBL13265413 0.79 F2 (0.54) ALDH1A1LMNAMEN1KMT2AMGLL
SCHEMBL11237048 0.79 KMT2A (0.60) NPSR1LMNAMEN1KMT2AMGLL
Chlorophthalium SCHEMBL315018 0.79 MEN1 (0.55) ALDH1A1LMNAMEN1KMT2AMGLL
SCHEMBL24939822 0.79 CA12 (0.62) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL11391976 0.79 ALDH1A1 (0.44) ALDH1A1NPSR1KDM4ELMNAMEN1
SCHEMBL16280099 0.78 MGLL (0.62) ALDH1A1NPSR1MEN1KMT2AMGLL
SCHEMBL9781414 0.77 NPC1 (0.60) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL9871954 0.77 TYMS (0.58) ALDH1A1KDM4EMEN1KMT2AALOX15
SCHEMBL23841260 0.77 KMT2A (0.65) ALDH1A1LMNAMEN1KMT2AMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10334851-B2 Herbicidal isoxazolo[5,4-B]pyridines BASF SE (DE) 2019-07-02 — — US claimed
US-20170367340-A1 Herbicidal Isoxazolo[5,4-B]pyridines BASF SE (DE) 2017-12-28 — — US claimed
US-20160037777-A1 Herbicidal Isoxazolo[5,4-B]pyridines BASF SE (DE) 2016-02-11 — — US claimed
US-RE37664-E1 Use of derivatives of N-phenl-3,4,5,6-tetrahydrophthalimide for the desiccation and abscission of plant organs BASF AKTIENGESSELLSCHAFT (DE) 2002-04-16 — — US claimed
EP-0385231-B1 Use of derivatives of N-phenyl-3,4,5,6-tetrahydrophthalimide in the desiccation and abscission of plant organs BASF AG (DE) 1996-09-18 — — EP claimed
EP-0493606-A1 HETEROCYCLE-SUBSTITUTED BENZENE DERIVATIVE, PRODUCTION THEREOF, AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-07-08 — — EP claimed
EP-0207894-B1 HERBICIDALLY ACTIVE DERIVATIVES OF N-PHENYL-3,4,5,6-TETRAHYDROPHTHALIMIDE CIBA-GEIGY AG (CH) 1991-11-21 — — EP claimed
EP-0456108-A2 Herbicidal agent comprising a N-phenyl-3,4,5,6-tetrahydrophthalimide and a derivative of phenoxyalkanecarboxylic acid BASF Aktiengesellschaft (DE) 1991-11-13 — — EP claimed
US-5045105-A Use of derivatives of n-phenyl-3,4,5,6-tetrahydrophthalimide for the desiccation and abscission of plant organs BASF AKTIENGESELLSCHAFT (DE) 1991-09-03 — — US claimed
EP-0385231-A1 Use of derivatives of N-phenyl-3,4,5,6-tetrahydrophthalimide in the desiccation and abscission of plant organs BASF Aktiengesellschaft (DE) 1990-09-05 — — EP claimed
US-4824476-A PLANT GROWTH REGULATOR CIBA-GEIGY CORPORATION (US) 1989-04-25 — — US claimed
EP-0126419-B1 2-SUBSTITUTED PHENYL-4,5,6,7-TETRAHYDRO-2H-ISOINDOLE-1,3-DIONES, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-08-17 — — EP claimed
EP-0111286-B1 NOVEL BETA-LACTAM DERIVATIVES AND PROCESS FOR PRODUCTION THEREOF Sanraku Incorporated (JP) 1988-03-02 — — EP claimed
EP-0207894-A1 Herbicidally active derivatives of N-phenyl-3,4,5,6-tetrahydrophthalimide CIBA-GEIGY AG (CH) 1987-01-07 — — EP claimed
JP-62000463-A — — None — — JP disclosed
JP-58206559-A — — None — — JP disclosed
JP-58206559-A — — None — — JP disclosed
JP-S58206559-A N-PHENYL-3,4,5,6-TETRAHYDROPHTHALIMIDE DERIVATIVE, ITS PREPARATION AND HERBICIDE CONTAINING THE SAME AS ACTIVE CONSTITUENT SUMITOMO CHEM CO LTD 1983-12-01 — — JP disclosed
JP-S5419965-A PREPARATION OF N-SUBSTITUTED PHENYL-3,4,5,6-TETRAHYDRO-PHTHALIMIDE MITSUBISHI CHEM IND LTD 1979-02-15 — — JP disclosed
US-3987056-A DISPROPORTIONATION OF N-ARYL-1,2,3,6-TETRAHYDROPHTHALIMIDES PHILLIPS PETROLEUM COMPANY (US) 1976-10-19 — — 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 (3 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-10334851-B2 Herbicidal isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 ALDH1A1 292/4885NPSR1 2866/4885KDM4E 972/4885
US-20160037777-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 ALDH1A1 292/4885NPSR1 2866/4885KDM4E 972/4885
US-20170367340-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 ALDH1A1 292/4885NPSR1 2866/4885KDM4E 972/4885

“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.