SCHEMBL19620963

SCHEMBL19620963

Cc1cc(C)c(CNC(=O)c2cc([S+](C)[O-])cc3c2c(C)cn3C2CCCC2)c(=O)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 20/20 0.56
BRD4 O60885 1/20 0.48
EZH1 Q92800 1/20 0.47
EED O75530 7/20 0.46
RBBP4 Q09028 7/20 0.46
SUZ12 Q15022 7/20 0.46
AEBP2 Q6ZN18 6/20 0.46
RBBP7 Q16576 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
SCHEMBL17970334 0.92 EZH2 (0.54) EZH2BRD4EZH1EEDRBBP4
SCHEMBL19620847 0.88 EZH2 (0.61) EZH2BRD4EZH1EEDRBBP4
SCHEMBL12180273 0.86 EZH2 (0.59) EZH2BRD4EZH1EEDRBBP4
SCHEMBL2592178 0.86 EZH2 (0.61) EZH2BRD4EZH1EEDRBBP4
SCHEMBL14726791 0.85 EZH2 (0.61) EZH2BRD4EZH1EEDRBBP4
SCHEMBL12180078 0.84 EZH2 (0.57) EZH2BRD4EZH1EEDRBBP4
SCHEMBL17970398 0.84 EZH2 (0.57) EZH2BRD4EZH1EEDRBBP4
SCHEMBL2594558 0.83 EZH2 (0.60) EZH2BRD4EZH1EEDRBBP4
SCHEMBL17970445 0.82 EZH2 (0.61) EZH2BRD4EZH1EEDRBBP4
SCHEMBL2595647 0.82 EZH2 (0.55) EZH2BRD4EZH1EEDRBBP4

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