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SCHEMBL1695613

SCHEMBL1695613

Cc1cc(C)c(CNC(=O)C2=CC(c3ccnc(N4CCOCC4)c3)N(C(C)C)C=C2)c(=O)[nH]1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 20/20 0.48
▸ EED O75530 13/20 0.48
▸ RBBP4 Q09028 13/20 0.48
▸ SUZ12 Q15022 13/20 0.48
▸ RBBP7 Q16576 1/20 0.48
▸ AEBP2 Q6ZN18 12/20 0.46
▸ EZH1 Q92800 1/20 0.43

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
SCHEMBL1694843 0.77 EZH2 (0.46) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL1695610 0.77 EZH2 (0.54) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL1694768 0.72 EZH2 (0.73) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL27983811 0.71 EZH2 (0.62) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL13467755 0.69 EZH2 (0.55) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL1695481 0.69 EZH2 (0.85) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL17026076 0.68 EZH2 (0.54) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL12180083 0.68 EZH2 (0.85) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL12180703 0.68 EZH2 (0.85) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL14972054 0.68 EZH2 (0.54) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2566479-A1 AZAINDAZOLES GlaxoSmithKline LLC (US) 2013-03-13 — — EP disclosed
WO-2012005805-A1 AZAINDAZOLES GLAXOSMITHKLINE LLC (US) 2012-01-12 — — WO disclosed