SCHEMBL18800350

SCHEMBL18800350

Cc1cc(C)c(CNCc2cccc3c2cnn3C2CCCC2)c(=O)[nH]1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 12/20 0.54
▸ PDE9A O76083 6/20 0.45
▸ EED O75530 1/20 0.43
▸ RBBP4 Q09028 1/20 0.43
▸ SUZ12 Q15022 1/20 0.43
▸ RBBP7 Q16576 1/20 0.43
▸ EZH1 Q92800 2/20 0.42

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
SCHEMBL18800384 0.90 PDE9A (0.45) EZH2PDE9AEZH1
SCHEMBL21418346 0.88 EZH2 (0.55) EZH2PDE9AEEDRBBP4SUZ12
SCHEMBL18800352 0.88 EZH1 (0.43) EZH2PDE9AEZH1
SCHEMBL18800382 0.87 EZH1 (0.44) EZH2PDE9AEZH1
SCHEMBL18800423 0.86 EZH2 (0.53) EZH2PDE9AEEDRBBP4SUZ12
SCHEMBL18800379 0.85 EZH1 (0.42) EZH2PDE9AEEDRBBP4SUZ12
SCHEMBL22517657 0.85 EZH2 (0.52) EZH2PDE9AEEDRBBP4SUZ12
SCHEMBL18800360 0.84 EZH2 (0.43) EZH2PDE9AEEDRBBP4SUZ12
SCHEMBL18800353 0.84 EZH1 (0.42) EZH2PDE9AEZH1
SCHEMBL22517703 0.84 EZH2 (0.49) EZH2PDE9AEEDRBBP4SUZ12

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
US-9637472-B2 Substituted 6,5-fused bicyclic heteroaryl compounds Epizyme, Inc. (US) 2017-05-02 — — US disclosed
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