SCHEMBL20170110

SCHEMBL20170110

CSCCN1CCC(N2CCC(c3cc(C(=O)NCc4c(C)cc(C)[nH]c4=O)c4cnn(C(C)C)c4n3)CC2)CC1

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 20/20 0.75
▸ EED O75530 3/20 0.75
▸ RBBP4 Q09028 3/20 0.75
▸ SUZ12 Q15022 3/20 0.75
▸ RBBP7 Q16576 3/20 0.75
▸ AEBP2 Q6ZN18 1/20 0.48
▸ EZH1 Q92800 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
SCHEMBL12683986 0.92 EZH2 (0.81) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL19391713 0.91 EZH2 (0.78) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL12684298 0.91 EZH2 (0.73) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL15490768 0.89 EZH2 (0.79) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL12499552 0.89 EZH2 (0.81) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL12499068 0.88 EZH2 (0.77) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL12684051 0.87 EZH2 (0.89) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL19391582 0.87 EZH2 (0.62) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL19391494 0.87 EZH2 (0.85) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL12499687 0.86 EZH2 (1.00) EZH2EEDRBBP4SUZ12RBBP7

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
EP-3323820-A1 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. (US) 2018-05-23 — — EP disclosed
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