SCHEMBL16115541

SCHEMBL16115541

Cc1cc(C)c(CNC(=O)c2cc(-c3ccc(C(F)(F)F)nc3)cc3c2ccn3CC2CCC2)c(=O)[nH]1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 20/20 0.60
▸ BRD4 O60885 1/20 0.60
▸ EED O75530 2/20 0.50
▸ SUZ12 Q15022 2/20 0.50
▸ RBBP4 Q09028 1/20 0.50
▸ RBBP7 Q16576 1/20 0.50
▸ AEBP2 Q6ZN18 1/20 0.50
▸ EZH1 Q92800 1/20 0.50

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
SCHEMBL16116298 0.92 EZH2 (0.60) EZH2BRD4EEDSUZ12RBBP4
SCHEMBL16115715 0.85 EZH2 (0.60) EZH2BRD4EEDSUZ12RBBP4
SCHEMBL16116053 0.83 EZH2 (0.53) EZH2EEDSUZ12EZH1
SCHEMBL2594802 0.81 EZH2 (0.72) EZH2EEDSUZ12RBBP4RBBP7
SCHEMBL16115846 0.80 GRIN2B (0.43) BRD4
SCHEMBL16116111 0.79 GRIN2B (0.43) BRD4
SCHEMBL16115918 0.78 EZH2 (0.72) EZH2EEDSUZ12RBBP4RBBP7
SCHEMBL19620972 0.78 EZH2 (0.72) EZH2EEDSUZ12RBBP4RBBP7
SCHEMBL16115816 0.77 EZH2 (0.70) EZH2EEDSUZ12RBBP4RBBP7
SCHEMBL2595894 0.76 EZH2 (0.63) EZH2EEDSUZ12RBBP4RBBP7

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-2014155301-A1 SUBSTITUTED BICYCLIC COMPOUNDS AS INHIBITORS OF EZH2 Piramal Enterprises Limited (IN) 2014-10-02 — — WO disclosed
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