SCHEMBL19621019

SCHEMBL19621019

C=C(NCc1c(C)cc(C)[nH]c1=O)c1cc(S(C)(=O)=O)cc2c1c(C)cn2C1CC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 20/20 0.42
▸ BRD4 O60885 1/20 0.40
▸ EED O75530 9/20 0.39
▸ SUZ12 Q15022 9/20 0.39
▸ RBBP4 Q09028 4/20 0.39
▸ AEBP2 Q6ZN18 3/20 0.39
▸ EZH1 Q92800 1/20 0.38
▸ RBBP7 Q16576 1/20 0.37

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
SCHEMBL2594899 0.90 EZH2 (0.52) EZH2BRD4EEDSUZ12RBBP4
SCHEMBL12180078 0.87 EZH2 (0.57) EZH2BRD4EEDSUZ12RBBP4
SCHEMBL2595647 0.79 EZH2 (0.55) EZH2BRD4EEDSUZ12RBBP4
SCHEMBL17584935 0.78 EZH2 (0.57) EZH2BRD4EEDSUZ12RBBP4
SCHEMBL2586392 0.76 EZH2 (0.58) EZH2EEDSUZ12RBBP4AEBP2
SCHEMBL12180390 0.76 EZH2 (0.54) EZH2BRD4EEDSUZ12RBBP4
SCHEMBL19620847 0.75 EZH2 (0.61) EZH2BRD4EEDSUZ12RBBP4
SCHEMBL12180403 0.74 EZH2 (0.62) EZH2BRD4EEDSUZ12RBBP4
SCHEMBL2592178 0.73 EZH2 (0.61) EZH2BRD4EEDSUZ12RBBP4
SCHEMBL12180273 0.73 EZH2 (0.59) EZH2BRD4EEDSUZ12RBBP4

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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