SCHEMBL16115487

SCHEMBL16115487

Cc1cc(C)c(N(C)C(=O)c2cc(-c3ccc(N4CCN(C(=O)O)CC4)nc3)cc3c2CCN3C)c(=O)[nH]1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 15/20 0.51
EED O75530 5/20 0.51
SUZ12 Q15022 5/20 0.51
EZH1 Q92800 6/20 0.41
RBBP4 Q09028 2/20 0.41
AEBP2 Q6ZN18 2/20 0.41
RBBP7 Q16576 1/20 0.41
HDAC6 Q9UBN7 4/20 0.39
HDAC1 Q13547 2/20 0.39

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
SCHEMBL16116157 0.93 EZH2 (0.47) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL16115078 0.91 EZH1 (0.47) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL16116261 0.90 EZH2 (0.51) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL16115485 0.83 EZH2 (0.72) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL16114977 0.82 EZH1 (0.50) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL16115298 0.81 EZH1 (0.47) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL16116153 0.80 EZH2 (0.63) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL16115003 0.79 EZH2 (0.66) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL16115079 0.78 EZH1 (0.66) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL16115764 0.75 EZH2 (0.69) EZH2EEDSUZ12EZH1RBBP4

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