SCHEMBL2592959

SCHEMBL2592959

Cc1cc(C)c(CNC(=O)c2cc(-c3cccc(N4CCN(C)CC4)n3)cc3c2c(C)cn3C(C)C)c(=O)[nH]1

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 18/20 0.76
EZH1 Q92800 4/20 0.76
EED O75530 9/20 0.58
SUZ12 Q15022 9/20 0.58
RBBP4 Q09028 3/20 0.57
RBBP7 Q16576 2/20 0.57
AEBP2 Q6ZN18 2/20 0.56
HDAC1 Q13547 1/20 0.55
HDAC6 Q9UBN7 1/20 0.54

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
SCHEMBL12180194 0.92 EZH2 (0.65) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL2595214 0.88 EZH2 (0.60) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL2592051 0.87 EZH2 (0.65) EZH2EZH1EEDSUZ12HDAC1
SCHEMBL2595868 0.86 EZH2 (1.00) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL29351554 0.86 EZH2 (1.00) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL12180118 0.86 EZH2 (0.63) EZH2EZH1EEDSUZ12HDAC1
SCHEMBL12180091 0.85 EZH2 (0.85) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL2592708 0.84 EZH2 (0.61) EZH2EZH1EEDSUZ12HDAC1
SCHEMBL16360903 0.84 EZH2 (0.61) EZH2EZH1EEDSUZ12HDAC1
SCHEMBL12180205 0.84 EZH2 (0.94) EZH2EZH1EEDSUZ12RBBP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011140324-A1 INDOLES GLAXOSMITHKLINE LLC (US) 2011-11-10 WO disclosed