SCHEMBL16116293

SCHEMBL16116293

CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(-c2ccc(N3CCN(C(=O)O)CC3)nc2)cc2c1C(C)(C)C(=O)N2C(C)C

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EZH1 Q92800 10/20 0.64
EZH2 Q15910 12/20 0.62
EED O75530 2/20 0.62
RBBP4 Q09028 2/20 0.62
SUZ12 Q15022 2/20 0.62
AEBP2 Q6ZN18 2/20 0.62
PRMT3 O60678 1/20 0.61
RBBP7 Q16576 1/20 0.61
SETD7 Q8WTS6 1/20 0.61

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
SCHEMBL16116238 0.93 EZH2 (0.71) EZH1EZH2EEDRBBP4SUZ12
SCHEMBL16116209 0.92 EZH1 (0.71) EZH1EZH2EEDRBBP4SUZ12
SCHEMBL16116331 0.92 EZH2 (0.61) EZH1EZH2EEDRBBP4SUZ12
SCHEMBL16114978 0.85 EZH1 (0.69) EZH1EZH2EEDRBBP4SUZ12
SCHEMBL16116240 0.84 EZH2 (0.71) EZH1EZH2EEDRBBP4SUZ12
SCHEMBL16115250 0.84 EZH1 (0.67) EZH1EZH2EEDRBBP4SUZ12
SCHEMBL16115079 0.83 EZH1 (0.66) EZH1EZH2EEDRBBP4SUZ12
SCHEMBL16115302 0.83 EZH1 (0.66) EZH1EZH2EEDRBBP4SUZ12
SCHEMBL16116292 0.83 EZH1 (0.65) EZH1EZH2EEDRBBP4SUZ12
SCHEMBL16115204 0.82 EZH2 (0.54) EZH1EZH2EEDRBBP4SUZ12

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