SCHEMBL19620889

SCHEMBL19620889

C=C(NCc1c(C)cc(C)[nH]c1=O)c1cc(Br)cc2c1ccn2C1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 20/20 0.56
▸ BRD4 O60885 2/20 0.56
▸ EZH1 Q92800 2/20 0.44
▸ EED O75530 1/20 0.44
▸ RBBP4 Q09028 1/20 0.44
▸ SUZ12 Q15022 1/20 0.44
▸ AEBP2 Q6ZN18 1/20 0.44

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
SCHEMBL2594805 0.90 EZH2 (0.65) EZH2BRD4EZH1EEDRBBP4
SCHEMBL14717700 0.79 EZH2 (0.62) EZH2BRD4EZH1EEDRBBP4
SCHEMBL12180071 0.79 EZH2 (0.65) EZH2BRD4EZH1EEDRBBP4
SCHEMBL2588878 0.79 EZH2 (0.67) EZH2BRD4EZH1EEDRBBP4
SCHEMBL12180087 0.78 EZH2 (0.62) EZH2BRD4EZH1EEDRBBP4
SCHEMBL2592178 0.78 EZH2 (0.61) EZH2BRD4EZH1EEDRBBP4
SCHEMBL14717619 0.77 EZH2 (0.62) EZH2BRD4EZH1EEDRBBP4
SCHEMBL20334119 0.77 EZH2 (0.68) EZH2BRD4EZH1
SCHEMBL14726791 0.77 EZH2 (0.61) EZH2BRD4EZH1EEDRBBP4
SCHEMBL30388272 0.76 EZH2 (0.75) EZH2EEDRBBP4SUZ12

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-3246027-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF CANCER GlaxoSmithKline LLC (US) 2017-11-22 — — EP disclosed
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