SCHEMBL79982

SCHEMBL79982

CCc1ccccc1CN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 2/20 0.50
DPP4 P27487 2/20 0.46
GABRA1 P14867 3/20 0.46
GABRB2 P47870 3/20 0.46
CSNK2A2 P19784 1/20 0.44
CSNK2B P67870 1/20 0.44
CSNK2A1 P68400 1/20 0.44
CSNK2A3 Q8NEV1 1/20 0.44
MGLL Q99685 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
LOXL2 Q9Y4K0 2/20 0.39
TP53 P04637 1/20 0.39

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
Hydrochloric Acid SCHEMBL2782160 0.97 PNMT (0.48) PNMTDPP4GABRA1GABRB2CSNK2A2
Bromide SCHEMBL28831558 0.97 PNMT (0.48) PNMTDPP4GABRA1GABRB2CSNK2A2
SCHEMBL4639617 0.95 PNMT (0.46) PNMTDPP4GABRA1GABRB2CSNK2A2
Lithium Ion SCHEMBL4639613 0.93 PNMT (0.44) PNMTDPP4GABRA1GABRB2CSNK2A2
Ethylamine SCHEMBL28337086 0.88 GABRA1 (0.50) PNMTGABRA1GABRB2CSNK2A2CSNK2B
Methylamine SCHEMBL28339099 0.85 PNMT (0.57) PNMTDPP4TAAR1SLC6A2SLC6A4
Methylamine SCHEMBL27540110 0.85 GABRA1 (0.52) GABRA1GABRB2CSNK2A2CSNK2BCSNK2A1
SCHEMBL25425763 0.85 GABRA1 (0.58) GABRA1GABRB2MGLLMAPTALDH1A1
SCHEMBL29405036 0.85 PNMT (0.63) PNMTDPP4TAAR1KDM4ESMN1; SMN2
SCHEMBL36294 0.85 GABRA1 (0.58) GABRA1GABRB2MGLLMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3896125-B1 A RUBBER COMPOSITION AND A RUBBER PRODUCT GOODYEAR TIRE & RUBBER (US) 2024-10-02 EP claimed
EP-2906608-B1 POLYANILINE MEMBRANES, USES, AND METHODS THERETO UNIV CALIFORNIA (US) 2024-09-25 EP claimed
EP-3102249-B1 ODOUR-MASKED AMINE COMPOSITION ARKEMA FRANCE (FR) 2019-10-16 EP claimed
EP-2682430-B1 METHOD FOR MANUFACTURING RESIN FOR THIOURETHANE-BASED OPTICAL MATERIAL USING UNIVERSAL POLYISOCYANATE COMPOUND, RESIN COMPOSITION, AND OPTICAL MATERIAL MANUFACTURED THEREBY KOC SOLUTION CO LTD (KR) 2015-10-21 EP claimed
EP-2310110-B1 ABSORBENT SOLUTION BASED ON N,N,N',N'-TETRAMETHYLHEXANE-1,6-DIAMINE AND ON ONE PARTICULAR AMINE COMPRISING PRIMARY OR SECONDARY AMINE FUNCTIONAL GROUPS AND PROCESS FOR REMOVING ACID COMPOUNDS FROM A GASEOUS EFFLUENT IFP Energies Nouvelles (FR) 2015-09-09 EP claimed
EP-2678364-B1 RHEOLOGICAL AGENT FOR RADIATION-CURABLE COATING MATERIALS BASF SE (DE) 2015-04-08 EP claimed
WO-2012113739-A1 RHEOLOGICAL AGENT FOR RADIATION-CURABLE COATING MATERIALS BASF SE (DE) 2012-08-30 WO claimed
JP-4800960-B2 2011-10-26 JP claimed
EP-1685095-B1 METHOD FOR THE PRODUCTION OF ORGANIC SALTS CONTAINING BIS(PERFLUOROALKYL)PHOSPHINATE ANIONS MERCK PATENT GMBH (DE) 2010-08-11 EP claimed
EP-1610779-B1 3-OXO-1,3-DIHYDRO-INDAZOLE-2-CARBOXYLIC ACID AMIDE DERIVATIVES AS PHOSPHOLIPASE INHIBITORS LILLY CO ELI (US) 2009-09-09 EP claimed
JP-2007516959-A 2007-06-28 JP claimed
EP-1685095-A1 METHOD FOR THE PRODUCTION OF ORGANIC SALTS CONTAINING BIS(PERFLUOROALKYL)PHOSPHINATE ANIONS MERCK PATENT GmbH (DE) 2006-08-02 EP claimed
WO-2005049555-A1 METHOD FOR THE PRODUCTION OF ORGANIC SALTS CONTAINING BIS(PERFLUOROALKYL)PHOSPHINATE ANIONS MERCK PATENT GMBH (DE) 2005-06-02 WO claimed
EP-0989953-B1 METHOD FOR CONCENTRATING PHOSPHORIC ACID ECOPHOS (BE) 2002-03-27 EP claimed
EP-0636616-B1 Process for production of fluoroalkanecarboxamide derivatives SUMITOMO CHEMICAL CO (JP) 1999-10-27 EP claimed
EP-0654026-B1 ISOSERINE DERIVATIVES AND THEIR USE AS LEUKOTRIENE ANTAGONISTS LEO PHARM PROD LTD (DK) 1997-02-19 EP claimed
EP-0496306-B1 Process for the preparation of 3-amino-9,13b-dihydro-1H-dibenz-[c,f]imidazo[1,5-a]azepine hydrochloride BOEHRINGER INGELHEIM KG (DE) 1995-09-13 EP claimed
EP-0420844-B1 SUBSTITUTED QUINOLINES LEO PHARM PROD LTD (DK) 1994-08-24 EP claimed
EP-0496306-A1 Process for the preparation of 3-amino-9,13b-dihydro-1H-dibenz-[c,f]imidazo[1,5-a]azepine hydrochloride BOEHRINGER INGELHEIM KG (DE) 1992-07-29 EP claimed
US-4522738-A Toilet bowl cleaner CELLO CORP. 1985-06-11 US claimed