SCHEMBL19503270

SCHEMBL19503270

C=CC(=O)N(c1cc(C(=O)NCc2c(CCC)cc(C)[nH]c2=O)cc(-c2ccc(N3CCN(I)CC3)nc2)c1)C1CCOCC1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 16/20 0.61
▸ EED O75530 2/20 0.53
▸ RBBP4 Q09028 2/20 0.53
▸ SUZ12 Q15022 2/20 0.53
▸ AEBP2 Q6ZN18 2/20 0.53
▸ EZH1 Q92800 4/20 0.51
▸ HDAC1 Q13547 1/20 0.51
▸ HDAC6 Q9UBN7 1/20 0.51
▸ PRMT3 O60678 1/20 0.49
▸ RBBP7 Q16576 1/20 0.49
▸ SETD7 Q8WTS6 1/20 0.49

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
SCHEMBL19503266 0.95 EZH2 (0.69) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19503285 0.93 EZH2 (0.69) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19503267 0.87 EZH2 (0.71) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL20991857 0.86 EZH2 (0.53) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19503505 0.84 EZH2 (0.81) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL20991849 0.84 EZH2 (0.67) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19503275 0.83 EZH2 (0.55) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19503268 0.81 EZH2 (0.69) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19503236 0.79 EZH2 (0.84) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL23863678 0.79 EZH1 (0.64) EZH2EEDRBBP4SUZ12AEBP2

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-2017184999-A1 EZH2 INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-10-26 — — WO disclosed
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