SCHEMBL2594076

SCHEMBL2594076

CCCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Br)cc2c1c(C)cn2C(C)C

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 15/20 0.60
EED O75530 4/20 0.56
SUZ12 Q15022 4/20 0.56
RBBP4 Q09028 3/20 0.56
AEBP2 Q6ZN18 3/20 0.56
EZH1 Q92800 7/20 0.51
HDAC1 Q13547 1/20 0.44

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
SCHEMBL2594866 0.95 EZH2 (0.67) EZH2EEDSUZ12RBBP4AEBP2
SCHEMBL12180072 0.92 EZH2 (0.58) EZH2EEDSUZ12RBBP4AEBP2
SCHEMBL2590225 0.90 EZH2 (0.52) EZH2EEDSUZ12RBBP4AEBP2
SCHEMBL2592559 0.88 EZH2 (0.64) EZH2EEDSUZ12RBBP4AEBP2
SCHEMBL30620946 0.88 EZH2 (0.64) EZH2EEDSUZ12RBBP4AEBP2
SCHEMBL12180167 0.87 EZH2 (0.61) EZH2EEDSUZ12RBBP4AEBP2
SCHEMBL12180138 0.86 EZH2 (0.65) EZH2EEDSUZ12RBBP4AEBP2
SCHEMBL2593214 0.86 EZH2 (0.65) EZH2EEDSUZ12RBBP4AEBP2
SCHEMBL2591080 0.86 EZH2 (0.56) EZH2EEDSUZ12RBBP4AEBP2
SCHEMBL19621000 0.85 EZH2 (0.54) EZH2EEDSUZ12RBBP4AEBP2

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
EP-2566327-A1 INDOLES GlaxoSmithKline LLC (US) 2013-03-13 EP claimed
WO-2011140324-A1 INDOLES GLAXOSMITHKLINE LLC (US) 2011-11-10 WO claimed