SCHEMBL3294485

SCHEMBL3294485

ClC(Cl)c1ccc2ccccc2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 3/20 0.46
CYP1A2 P05177 2/20 0.46
NOS2 P35228 1/20 0.46
BACE1 P56817 1/20 0.46
CA12 O43570 1/20 0.46
CA9 Q16790 1/20 0.46
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 1/20 0.45
S1PR3 Q99500 1/20 0.44
GLA P06280 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
ACHE P22303 1/20 0.42
MGAM O43451 1/20 0.41
CNR2 P34972 1/20 0.41
RAB9A P51151 7/20 0.39
NPC1 O15118 6/20 0.39
AR P10275 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 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
SCHEMBL7461862 0.83 ALDH1A1 (0.50) NCF1CYP1A2NOS2BACE1CA12
SCHEMBL4848414 0.83 CYP1A2 (0.48) NCF1CYP1A2NOS2BACE1CA12
SCHEMBL20746476 0.83 NCF1 (0.43) NCF1CYP1A2NOS2BACE1CA12
SCHEMBL9009627 0.81 NCF1 (0.50) NCF1CYP1A2NOS2BACE1CA12
Hydrochloric Acid SCHEMBL27438833 0.81 CYP1A2 (0.47) NCF1CYP1A2NOS2BACE1CA12
SCHEMBL10518600 0.78 ALDH1A1 (0.46) NCF1CYP1A2NOS2BACE1CA12
SCHEMBL30106721 0.77 NCF1 (0.46) NCF1CYP1A2NOS2BACE1CA12
SCHEMBL10020390 0.77 ALDH1A1 (0.53) NCF1CYP1A2NOS2BACE1CA12
SCHEMBL1129147 0.77 NCF1 (0.46) NCF1CYP1A2NOS2BACE1CA12
SCHEMBL27568530 0.77 NCF1 (0.52) NCF1CYP1A2NOS2BACE1CA12

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103038229-B Heteroaryl compounds and methods of use thereof SUNOVION PHARMACEUTICALS INC. (US) 2016-05-11 CN disclosed
CN-104725379-A Preparation method and application of purine ketone derivatives and composition thereof HANGZHOU MINSHENG PHARM GROUP 2015-06-24 CN disclosed
CN-101195672-B Method for producing olefin-copolymerization catalyst and method for producing olefin-copolymers SUMITOMO CHEMICAL CO 2011-07-06 CN disclosed
US-7732540-B2 Process for producing olefin copolymerization catalyst and process for producing olefin copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-08 US disclosed
US-20090018012-A1 Process for Producing Olefin Copolymerization Catalyst and Process for Producing Olefin Copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-15 US disclosed
CN-101195672-A Method for producing olefin-copolymerization catalyst and method for producing olefin-copolymers SUMITOMO CHEMICAL CO (JP) 2008-06-11 CN disclosed
US-7285375-B2 Photosensitive composition, photosensitive lithography plate and method for producing lithography plate KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-10-23 US disclosed
US-7285375-B2 Photosensitive composition, photosensitive lithography plate and method for producing lithography plate KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-10-23 US disclosed
US-20070020555-A1 Photosensitive composition, photosensitive lithography plate and method for producing lithography plate KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-01-25 US disclosed
US-20070020555-A1 Photosensitive composition, photosensitive lithography plate and method for producing lithography plate KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-01-25 US disclosed
CN-1183113-C Tri-aryl acid derivatives as PPAR receptor ligands ���ĵ�˹ҩ��¹����޹�˾ 2005-01-05 CN disclosed
CN-1356983-A Tri-aryl acid derivatives as PPAR receptor ligands AVENTIS PHARM PROD INC (DE) 2002-07-03 CN disclosed
EP-0204352-B1 CHLORINATION OF ALKYL SIDE CHAINS OF NITROGEN-CONTAINING HETEROCYCLES RÜTGERSWERKE AKTIENGESELLSCHAFT (DE) 1990-04-18 EP disclosed
US-4719298-A WITH TRICHLOROISOCYANURIC ACID RUTGERSWERKE AKTIENGESELLSCHAFT (DE) 1988-01-12 US disclosed
EP-0204352-A2 Chlorination of alkyl side chains of nitrogen-containing heterocycles RÜTGERSWERKE AKTIENGESELLSCHAFT (DE) 1986-12-10 EP disclosed
EP-0085182-B1 PROCESS FOR THE PREPARATION OF QUINOLINE MONOCARBOXYLIC ACID BASF Aktiengesellschaft (DE) 1986-04-23 EP disclosed
EP-0085182-A2 Process for the preparation of quinoline monocarboxylic acid BASF Aktiengesellschaft (DE) 1983-08-10 EP disclosed