SCHEMBL25544404

SCHEMBL25544404

CCCCCCn1ncc2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(N3CCN(CCO)CC3)cc21

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 13/20 0.54
▸ EZH1 Q92800 3/20 0.54
▸ HDAC6 Q9UBN7 7/20 0.51
▸ HDAC1 Q13547 5/20 0.51
▸ EED O75530 3/20 0.47
▸ RBBP4 Q09028 3/20 0.47
▸ SUZ12 Q15022 3/20 0.47
▸ RBBP7 Q16576 3/20 0.47
▸ AEBP2 Q6ZN18 1/20 0.47

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
SCHEMBL12684492 0.84 EZH2 (0.60) EZH2EZH1HDAC6EEDRBBP4
SCHEMBL12684439 0.78 EZH2 (0.60) EZH2EZH1HDAC6EEDRBBP4
SCHEMBL12498441 0.74 EZH2 (0.65) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL12684460 0.73 EZH2 (0.62) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL2595453 0.73 EZH2 (0.71) EZH2EZH1HDAC6HDAC1EED
SCHEMBL12684211 0.72 EZH2 (0.67) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL21418342 0.72 EZH2 (0.48) EZH2EZH1HDAC6HDAC1EED
SCHEMBL19391463 0.71 EZH2 (0.49) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL15491016 0.70 EZH2 (0.67) EZH2EZH1HDAC6EEDRBBP4
SCHEMBL19391672 0.69 EZH2 (0.73) 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-B1 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS EPIZYME INC (US) 2023-05-10 — — EP disclosed
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