SCHEMBL93192

SCHEMBL93192

Cc1cccc(N=C=O)c1C

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.79
TRPA1 O75762 2/20 0.47
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
ATM Q13315 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.36
TSHR P16473 3/20 0.36
ALDH1A1 P00352 4/20 0.36
TDP1 Q9NUW8 4/20 0.36
HPGD P15428 2/20 0.36
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
MAPT P10636 5/20 0.34
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2A6 P11509 1/20 0.33
LMNA P02545 2/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL29440559 1.00 CYP3A4 (0.79) CYP3A4TRPA1GABRA1GABRB2ATM
SCHEMBL15092 0.89 CYP3A4 (1.00) CYP3A4TRPA1GABRA1GABRB2TSHR
SCHEMBL27946613 0.86 CYP3A4 (0.95) CYP3A4TRPA1GABRA1GABRB2TSHR
SCHEMBL28583292 0.83 CYP3A4 (0.87) CYP3A4TRPA1GABRA1GABRB2TSHR
SCHEMBL93287 0.82 CYP3A4 (0.64) CYP3A4TRPA1GABRA1GABRB2SMN1; SMN2
SCHEMBL1416730 0.82 CYP3A4 (0.52) CYP3A4TRPA1ATMSMN1; SMN2TSHR
SCHEMBL29541215 0.82 CYP3A4 (0.64) CYP3A4TRPA1GABRA1GABRB2SMN1; SMN2
SCHEMBL8673923 0.81 CYP3A4 (0.53) CYP3A4TRPA1SMN1; SMN2TSHRALDH1A1
SCHEMBL14405562 0.81 CYP3A4 (0.83) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL20145 0.81 CYP3A4 (0.63) CYP3A4TRPA1GABRA1GABRB2ATM

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 1173 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3529319-B1 RHEOLOGY-MODIFYING URETHANE COMPOUND COATEX SAS (FR) 2025-07-30 EP claimed
CN-114656602-B Prepolymer for polymer polyol and preparation method thereof 万华化学集团股份有限公司 2023-12-19 CN claimed
CN-112996835-B Method for producing thermoplastic polyoxazolidone polymers 科思创知识产权两合公司 2022-12-13 CN claimed
CN-111100732-B Soap urethane lubricating grease and preparation method thereof 中国石油化工股份有限公司 2022-10-21 CN claimed
EP-3356324-B1 METHOD FOR MAKING ISOCYANATES COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2022-10-05 EP claimed
US-11427671-B2 Method for the production of thermoplastic polyoxazolidinone polymers COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2022-08-30 US claimed
EP-3873961-B1 METHOD FOR THE PRODUCTION OF THERMOPLASTIC POLYOXAZOLIDINONE POLYMERS COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2022-08-17 EP claimed
US-11370874-B2 Method for the production of thermoplastic polyoxazolidone polymers COVESTRO DEUTSCHLAND AG (DE) 2022-06-28 US claimed
CN-114656602-A Prepolymer for polymer polyol and preparation method thereof 万华化学集团股份有限公司 2022-06-24 CN claimed
EP-3681924-B1 METHOD FOR THE PRODUCTION OF THERMOPLASTIC POLYOXAZOLIDINONE POLYMERS COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2022-05-18 EP claimed
US-20070123642-A1 Phase change inks containing curable isocyanate-derived compounds XEROX CORPORATION 2007-05-31 US claimed
US-20070120909-A1 Phase change inks containing curable isocyanate-derived compounds and phase change inducing components XEROX CORPORATION 2007-05-31 US claimed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
US-5663272-A STORAGE STABLE LIQUID MADE FROM DIPHENYLMETHANE DIISOCYANATE AND MONOISOCYANATES BAYER CORPORATION (US) 1997-09-02 US claimed
US-5567793-A PRODUCING STORAGE STABLE LIQUID ALLOPHANATE-MODIFIED DIPHENYLMETHANE DIISOCYANATE BY REACTING HYDROXYL CONTAINING COMPOUND WITH MONOISOCYANATE, REACTING PRODUCT WITH MIXTURE OF DIPHENYLMETHANE DIISOCYANATE ISOMERS BAYER CORPORATION (US) 1996-10-22 US claimed
US-4918148-A IMPROVED FLOWABILITY, MOLD RELEASE AND-OR NOTCHED IMPACT STRENGTH BAYER AKTIENGESELLSCHAFT (DE) 1990-04-17 US claimed
CN-86108166-A Improved products and production method thereof 1987-07-22 CN claimed
EP-0019349-B1 STABILIZING COMPOSITION FOR POLYARYLENE ESTERS, STABILIZED POLYARYLENE ESTER, MOULDED ARTICLE PRODUCED THEREFROM AND PROCESS FOR STABILIZING A POLYARYLENE ESTER MONSANTO COMPANY (US) 1983-08-03 EP claimed
EP-0019349-A1 Stabilizing composition for polyarylene esters, stabilized polyarylene ester, moulded article produced therefrom and process for stabilizing a polyarylene ester MONSANTO COMPANY (US) 1980-11-26 EP claimed
US-4222932-A MOLDING MATERIALS STABILIZED BY ADDING AN AROMATIC ISOCYANATE AND AN ALIPHATIC PHOSPHITE MONSANTO COMPANY (US) 1980-09-16 US claimed