SCHEMBL325486

SCHEMBL325486

O=C=NCc1ccccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.45
PNMT P11086 1/20 0.45
TAAR1 Q96RJ0 4/20 0.44
PYCR1 P32322 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
CTBP2 P56545 1/20 0.41
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
GRIN2B Q13224 3/20 0.39
GRIN1 Q05586 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
HTR3A P46098 1/20 0.39
HTR3D Q70Z44 1/20 0.39
HTR3C Q8WXA8 1/20 0.39
PKM P14618 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL29364508 0.84 GABRA1 (0.41) TAAR1CTBP2GABRA1GABRB2ALDH1A1
SCHEMBL127043 0.84 GABRA1 (0.41) TAAR1CTBP2GABRA1GABRB2ALDH1A1
SCHEMBL1568684 0.84 PNMT (0.50) IDO1PNMTTAAR1GABRA1GABRB2
SCHEMBL19138738 0.82 GABRA1 (0.40) IDO1PNMTTAAR1PYCR1GABRA1
SCHEMBL28225610 0.82 GABRA1 (0.40) GABRA1GABRB2ALDH1A1
Water SCHEMBL5172983 0.82 GABRA1 (0.40) GABRA1GABRB2ALDH1A1
Benzene SCHEMBL28107745 0.82 GABRA1 (0.40) CTBP2GABRA1GABRB2ALDH1A1
SCHEMBL4901882 0.81 GABRA1 (0.39) IDO1PNMTTAAR1PYCR1GABRA1
SCHEMBL5480950 0.80 HTR3E (0.53) IDO1PNMTTAAR1PYCR1NPC1
SCHEMBL1457250 0.79 MIF (0.52) IDO1PNMTTAAR1PYCR1GABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
JP-56040667-A None JP disclosed
CN-122059940-A Mountain lotus leaf essence urea derivative and preparation method and application thereof 南通大学 2026-05-19 CN disclosed
EP-4713378-A1 ESTERIFIED ETHANOLAMINES FOR PREPARING ISOCYANURATE POLYMERS Covestro Deutschland AG (DE) 2026-03-25 EP disclosed
CN-121181450-A Continuous synthesis process of 1- (2-chlorophenyl) -3- (1-methyl-1-phenylethyl) urea 江苏莱科化学有限公司 2025-12-23 CN disclosed
EP-3774961-B1 ADDUCTS OF AMINE CATALYSTS FOR PRODUCING ISOCYANURATE POLYMERS COVESTRO DEUTSCHLAND AG (DE) 2025-01-15 EP disclosed
CN-119039287-A Tetrahydropyridopyrimidinone derivative, and preparation method and application thereof 中国药科大学 2024-11-29 CN disclosed
WO-2024236000-A1 ESTERIFIED ETHANOLAMINES FOR PREPARING ISOCYANURATE POLYMERS COVESTRO DEUTSCHLAND AG (DE) 2024-11-21 WO disclosed
EP-4464727-A1 ESTERIFIED ETHANOLAMINES FOR THE PREPARATION OF ISOCYANURATE POLYMERS Covestro Deutschland AG (DE) 2024-11-20 EP disclosed
WO-2024099520-A1 4-HYDROXYBICYCLO[3.3.1]NON-3-ENE-2,9-DIONE DERIVATIVES AND USE THEREOF Technische Universität Dresden, Körperschaft des öffentlichen Rechts (DE) 2024-05-16 WO disclosed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US disclosed
WO-2002006246-A1 DIHYDROXYPYRIMIDINE CARBOXYLIC ACIDS AS VIRAL POLYMERASE INHIBITORS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2002-01-24 WO disclosed
WO-2001079193-A2 SUBSTITUTED HYDRAZINYL HETEROAROMATIC INHIBITORS OF THROMBIN CORVAS INTERNATIONAL, INC. (US) 2001-10-25 WO disclosed
EP-0915651-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2001-10-24 EP disclosed
US-6271261-B1 CHEMOKINE MEDIATED DISEASES, BINDING INTERLEUKINS OR BETA-RECEPTORS AND ADMINISTERING TO MAMMALS SMITHKLINE BEECHAM CORPORATION 2001-08-07 US disclosed
EP-0915651-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-05-19 EP disclosed
WO-1997049286-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-12-31 WO disclosed
EP-0362001-B1 N-CYCLOALKYL BENZYLAMINES ALPHA,ALPHA DISUBSTITUTED, THE PROCESS FOR THEIR PREPARATION, THEIR USE AS DRUGS AND THEIR SYNTHESIS INTERMEDIATES JOUVEINAL S.A. (FR) 1993-03-10 EP disclosed
EP-0362001-A1 N-cycloalkyl benzylamines alpha,alpha disubstituted, the process for their preparation, their use as drugs and their synthesis intermediates JOUVEINAL S.A. (FR) 1990-04-04 EP disclosed
JP-S5640667-A UREA DERIVATIVE ISHIHARA SANGYO KAISHA LTD 1981-04-16 JP disclosed