SCHEMBL1998633

SCHEMBL1998633

ClCc1ccc2c(c1)[nH]c1ccccc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 11/20 0.68
ALDH1A1 P00352 2/20 0.58
KDM4E B2RXH2 1/20 0.58
AHR P35869 1/20 0.57
GPR3 P46089 1/20 0.54
HSD17B10 Q99714 1/20 0.54
GABRP O00591 2/20 0.43
GABRD O14764 2/20 0.43
GABRA1 P14867 2/20 0.43
GABRB1 P18505 2/20 0.43
GABRG2 P18507 2/20 0.43
GABRB3 P28472 2/20 0.43
GABRA5 P31644 2/20 0.43
GABRA3 P34903 2/20 0.43
GABRA2 P47869 2/20 0.43
GABRB2 P47870 2/20 0.43
GABRA4 P48169 2/20 0.43
GABRE P78334 2/20 0.43
GABRA6 Q16445 2/20 0.43
GABRG1 Q8N1C3 2/20 0.43

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
SCHEMBL30196772 0.89 AHR (0.57) KIF11ALDH1A1KDM4EAHRGPR3
SCHEMBL22089502 0.89 AHR (0.57) KIF11ALDH1A1KDM4EAHRGPR3
SCHEMBL28165978 0.81 KIF11 (0.68) KIF11ALDH1A1KDM4EAHRGPR3
SCHEMBL278610 0.81 KIF11 (1.00) KIF11ALDH1A1KDM4EAHRGPR3
SCHEMBL26658373 0.79 KIF11 (0.66) KIF11ALDH1A1KDM4EAHRGPR3
Carbazole SCHEMBL27765145 0.79 ALDH1A1 (0.78) KIF11ALDH1A1KDM4EAHRGPR3
SCHEMBL5497680 0.78 KIF11 (0.64) KIF11ALDH1A1KDM4EAHRGPR3
SCHEMBL29213721 0.78 KIF11 (0.64) KIF11ALDH1A1KDM4EAHRGPR3
SCHEMBL6009616 0.78 KIF11 (0.74) KIF11ALDH1A1KDM4EAHRGPR3
SCHEMBL2312163 0.78 KIF11 (0.64) KIF11ALDH1A1KDM4EAHRGPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1857471-B1 POLYMERIZATION CATALYST COMPOSITION AND PROCESS FOR PRODUCTION OF POLYMER MITSUI CHEMICALS INC (JP) 2013-04-24 EP disclosed
US-7960305-B2 a mixture of a phosphazenium compound such as tetrakis[tris(dimethylamino)phosphoranylideneamino]phosphonium chloride, transition metal halides and an organic halogen compound as an activator, used for addition homo/copolymerization; living polymers MITSUI CHEMICALS, INC. (JP) 2011-06-14 US disclosed
CN-101128491-B Polymerization catalyst composition and method for producing polymer MITSUI CHEMICALS INC 2010-09-08 CN disclosed
US-20080177014-A1 Polymerization Catalyst Composition and Process for Production of Polymer MITSUI CHEMICALS, INC. (JP) 2008-07-24 US disclosed
CN-101128491-A Polymerization catalyst composition and method for producing polymer MITSUI CHEMICALS INC (JP) 2008-02-20 CN disclosed
EP-1857471-A1 POLYMERIZATION CATALYST COMPOSITION AND PROCESS FOR PRODUCTION OF POLYMER Mitsui Chemicals, Inc. (JP) 2007-11-21 EP disclosed