Sugi Predict

Sugi Predict / Compounds / SCHEMBL9940409

SCHEMBL9940409

SCHEMBL9940409

CCCCN(C)C.OC1c2ccccc2-c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 2/20 0.49
▸ HRH1 P35367 2/20 0.49
▸ BCHE P06276 1/20 0.45
▸ ACHE P22303 1/20 0.45
▸ GPR3 P46089 1/20 0.41
▸ SLC22A2 O15244 1/20 0.41
▸ SLC22A3 O75751 1/20 0.41
▸ CDK8 P49336 1/20 0.40
▸ CDK5 Q00535 1/20 0.40
▸ KDM4E B2RXH2 3/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL28167099 0.77 GPR3 (0.55) HTR2AHRH1BCHEACHEGPR3
SCHEMBL28058725 0.75 BCHE (0.39) BCHEACHEGPR3SLC22A2SLC22A3
SCHEMBL29376368 0.74 MAOA (0.52) HTR2AGPR3KDM4EMEN1ALDH1A1
SCHEMBL29884836 0.74 MAOA (0.52) HTR2AGPR3KDM4EMEN1ALDH1A1
SCHEMBL216862 0.74 MAOA (0.52) HTR2AGPR3KDM4EMEN1ALDH1A1
SCHEMBL11777171 0.73 SIGMAR1 (0.43) HTR2AHRH1GPR3SLC22A2SLC22A3
SCHEMBL27688305 0.72 MAOA (0.50) HTR2AGPR3KDM4EMEN1ALDH1A1
SCHEMBL1930285 0.71 GPR3 (0.53) HTR2AHRH1BCHEACHEGPR3
SCHEMBL27837995 0.71 LTA4H (0.57) HTR2AHRH1ALDH1A1TP53CYP3A4
Dimethylamine SCHEMBL15440642 0.71 MAOA (0.44) HTR2ABCHEACHEGPR3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3599857-B1 HERBICIDAL MIXTURES BAYER AG (DE) 2023-08-23 — — EP claimed
US-20210289781-A1 HERBICIDAL MIXTURES BAYER AKTIENGESELLSCHAFT (DE) 2021-09-23 — — US claimed
EP-3823450-A1 HERBICIDAL MIXTURES CONTAINING ACLONIFEN AND CINMETHYLIN Bayer Aktiengesellschaft (DE) 2021-05-26 — — EP claimed
US-20210137117-A1 HERBICIDAL MIXTURES FMC CORPORATION 2021-05-13 — — US claimed
US-10932467-B2 Herbicidal mixtures BAYER AKTIENGESELLSCHAFT (DE) 2021-03-02 — — US claimed
EP-3599857-A1 HERBICIDAL MIXTURES Bayer Aktiengesellschaft (DE) 2020-02-05 — — EP claimed
EP-3599856-A1 HERBICIDAL MIXTURES CONTAINING 2-[2,4-DICHLOROPHENYL)METHYL]4,4-DIMETHYL-3-ISOXAZOLIDINONE, PYROXASULFONE AND MEFENPYR-DIETHYL Bayer Aktiengesellschaft (DE) 2020-02-05 — — EP claimed
WO-2020016134-A1 HERBICIDAL MIXTURES CONTAINING ACLONIFEN AND CINMETHYLIN BAYER AKTIENGESELLSCHAFT (DE) 2020-01-23 — — WO claimed
WO-2018172442-A1 HERBICIDAL MIXTURES BAYER AKTIENGESELLSCHAFT (DE) 2018-09-27 — — WO claimed
WO-2018172325-A1 HERBICIDAL MIXTURES CONTAINING 2-[2,4-DICHLOROPHENYL)METHYL]4,4-DIMETHYL-3-ISOXAZOLIDINONE, PYROXASULFONE AND MEFENPYR-DIETHYL BAYER AKTIENGESELLSCHAFT (DE) 2018-09-27 — — WO claimed
US-20140310835-A1 SOYBEAN EVENT SYHT04R AND COMPOSITIONS AND METHODS FOR DETECTION THEREOF SYNGENTA PARTICIPATIONS AG (CH) 2014-10-16 — — US claimed
WO-2012082542-A2 SOYBEAN EVENT SYHT04R AND COMPOSITIONS AND METHODS FOR DETECTION THEREOF SYNGENTA PARTICIPATIONS AG (CH) 2012-06-21 — — WO claimed
US-20240239755-A1 SUBSTITUTED PYRIDAZINONES, SALTS OR N-OXIDES THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2024-07-18 — — US disclosed
EP-4399212-A1 SUBSTITUTED 2,3-DIHYDRO[1,3]THIAZOLO[4,5-B]PYRIDINES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2024-07-17 — — EP disclosed
EP-3994130-B1 SUBSTITUTED THIOPHENE CARBOXAMIDES AND DERIVATIVES THEREOF AS MICROBICIDES BAYER AG (DE) 2024-07-10 — — EP disclosed
WO-2024137625-A1 SOPHOROLIPIDS AND SOPHOROLIPID DERIVATIVES AS TANK MIX ADDITIVES AND ADJUVANTS IN CROP PROTECTION FORMULATIONS LOCUS SOLUTIONS IPCO, LLC (US) 2024-06-27 — — WO disclosed
WO-2013135126-A1 RICE TRANSPLANTER-MOUNTED LIQUID REAGENT APPLICATION DEVICE, AND METHOD OF APPLYING LIQUID REAGENT DURING RICE PLANTING USING SAME YAMATO NOHJI CO., LTD. (JP) 2013-09-19 — — WO disclosed
WO-2012082542-A2 SOYBEAN EVENT SYHT04R AND COMPOSITIONS AND METHODS FOR DETECTION THEREOF SYNGENTA PARTICIPATIONS AG (CH) 2012-06-21 — — WO disclosed
WO-2012080187-A1 6-(2-AMINOPHENYL)PICOLINATES AND THEIR USE AS HERBICIDES BAYER CROPSCIENCE AG (DE) 2012-06-21 — — WO disclosed
WO-2012082548-A2 SOYBEAN EVENT SYHT0H2 AND COMPOSITIONS AND METHODS FOR DETECTION THEREOF SYNGENTA PARTICIPATIONS AG (CH) 2012-06-21 — — WO 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 (4 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-20210289781-A1 HERBICIDAL MIXTURES ATL3, DDT, CLSPN HTR2A 4698/4885HRH1 3808/4885BCHE 623/4885
US-10932467-B2 Herbicidal mixtures DDT, PRDX5, DHX35 HTR2A 1967/4885HRH1 4320/4885BCHE 2833/4885
US-20210137117-A1 HERBICIDAL MIXTURES DDT, MTX2, ATL3 HTR2A 3200/4885HRH1 3410/4885BCHE 1490/4885
US-20240239755-A1 SUBSTITUTED PYRIDAZINONES, SALTS OR N-OXIDES THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES PNPO, WEE1, PDXK HTR2A 2728/4885HRH1 2249/4885BCHE 1328/4885

“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.