SCHEMBL16116149

SCHEMBL16116149

Cc1cc(C)c(CNC(=O)c2cc(-c3ccc(N4CCOCC4)cc3)cc3c2CCN3C(C)C)c(=O)[nH]1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 20/20 0.64
EZH1 Q92800 4/20 0.61
EED O75530 3/20 0.59
SUZ12 Q15022 3/20 0.59
RBBP4 Q09028 2/20 0.59
AEBP2 Q6ZN18 2/20 0.59

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
SCHEMBL16115871 0.90 EZH2 (0.57) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL14730095 0.88 EZH2 (0.71) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16116018 0.85 EZH2 (0.57) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115294 0.83 EZH2 (0.58) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16116270 0.83 EZH2 (0.68) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115913 0.82 EZH2 (0.55) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16114975 0.82 EZH2 (0.70) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115548 0.81 EZH2 (0.76) EZH2EZH1EEDSUZ12RBBP4
Hydrochloric Acid SCHEMBL16116117 0.81 EZH2 (0.75) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115786 0.80 EZH2 (0.65) 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 2 patents. 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 claimed
WO-2014155301-A1 SUBSTITUTED BICYCLIC COMPOUNDS AS INHIBITORS OF EZH2 Piramal Enterprises Limited (IN) 2014-10-02 WO disclosed