SCHEMBL4270992

SCHEMBL4270992

OCCc1cc(CCO)nc(CCO)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
ALOX5 P09917 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
BACE1 P56817 1/20 0.39
CA2 P00918 2/20 0.39
CDK8 P49336 1/20 0.37
RIPK1 Q13546 1/20 0.35
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31

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
SCHEMBL11030679 0.84 KMT2A (0.37) TDP1KDM4EALDH1A1ALOX5GAA
SCHEMBL5031161 0.79 CA2 (0.39) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL63871 0.76 TDP1 (0.53) TDP1KDM4EALDH1A1ALOX5GAA
SCHEMBL4273861 0.74 KDM4E (0.30) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL6987053 0.72 RECQL (0.40) TDP1KDM4EALDH1A1ALOX5GAA
SCHEMBL1569427 0.72 TDP1 (0.39) TDP1KDM4EALDH1A1ALOX5GAA
SCHEMBL4273309 0.70 KCNH2 (0.52) TDP1CA2KCNH2
SCHEMBL4268319 0.70 PIM1 (0.35) TDP1KDM4E
SCHEMBL5842341 0.69 TDP1 (0.33) TDP1CA2
SCHEMBL4270997 0.69 CA2 (0.34) KDM4EALDH1A1ALOX5GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7605215-B2 Process for producing olefin copolymerization catalyst and process for producing olefin copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-10-20 US disclosed
US-20080227937-A1 Process for Producing Olefin Copolymerization Catalyst and Process for Producing Olefin Copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-18 US disclosed