SCHEMBL16115014

SCHEMBL16115014

CCN1CCc2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(-c3ccc(N4CCNCC4)nc3)cc21

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 19/20 0.67
EZH1 Q92800 8/20 0.67
EED O75530 4/20 0.66
SUZ12 Q15022 4/20 0.66
RBBP4 Q09028 1/20 0.57
RBBP7 Q16576 1/20 0.57
AEBP2 Q6ZN18 1/20 0.57

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
SCHEMBL16115465 0.94 EZH2 (0.66) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115865 0.93 EZH2 (0.66) EZH2EZH1EEDSUZ12
SCHEMBL16115841 0.92 EZH1 (0.68) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16116124 0.91 EZH2 (0.68) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115907 0.91 EZH2 (0.69) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115548 0.89 EZH2 (0.76) EZH2EZH1EEDSUZ12RBBP4
Hydrochloric Acid SCHEMBL16116117 0.88 EZH2 (0.75) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16116226 0.86 EZH1 (0.70) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115555 0.86 EZH2 (0.67) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115764 0.86 EZH2 (0.69) 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