SCHEMBL16360911

SCHEMBL16360911

Cc1cc(C)c(CNC(=O)c2cc(-c3ccc(O)cc3)cc3c2c(Cl)cn3C(C)C)c(=O)[nH]1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 17/20 0.66
EZH1 Q92800 3/20 0.60
EED O75530 1/20 0.52
SUZ12 Q15022 1/20 0.52
BRD4 O60885 1/20 0.51
HDAC1 Q13547 3/20 0.48
HDAC6 Q9UBN7 2/20 0.48
PARP1 P09874 1/20 0.48

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
SCHEMBL2590211 0.92 EZH2 (0.65) EZH2EZH1EEDSUZ12BRD4
SCHEMBL14717539 0.92 EZH2 (0.65) EZH2EZH1EEDSUZ12BRD4
SCHEMBL14717877 0.91 EZH2 (0.64) EZH2EZH1EEDSUZ12BRD4
SCHEMBL16360912 0.91 EZH2 (0.59) EZH2EZH1EEDSUZ12BRD4
SCHEMBL14717481 0.90 EZH2 (0.63) EZH2EZH1EEDSUZ12BRD4
SCHEMBL12180159 0.90 EZH2 (0.62) EZH2EZH1EEDSUZ12
SCHEMBL2596100 0.90 EZH2 (0.60) EZH2EZH1EEDSUZ12BRD4
SCHEMBL2596013 0.89 EZH2 (0.61) EZH2EZH1EEDSUZ12BRD4
SCHEMBL2593948 0.89 EZH2 (0.60) EZH2EZH1EEDSUZ12BRD4
SCHEMBL14718173 0.87 EZH2 (0.65) EZH2EZH1EEDSUZ12HDAC1

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-2013067296-A1 METHOD OF TREATMENT GLAXOSMITHKLINE INTELLECTUAL PROPERTY (No 2) LIMITED (GB) 2013-05-10 WO disclosed