SCHEMBL19620910

SCHEMBL19620910

C/C=C(/C)c1c(C)cc(-c2ccc(N3CCN(C)CC3)nc2)cc1C(=O)NCc1c(C(C)C)cc(C)[nH]c1=O

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 19/20 0.64
▸ EZH1 Q92800 4/20 0.64
▸ EED O75530 8/20 0.62
▸ SUZ12 Q15022 8/20 0.62
▸ RBBP4 Q09028 4/20 0.62
▸ AEBP2 Q6ZN18 4/20 0.62
▸ RBBP7 Q16576 2/20 0.62
▸ PRMT3 O60678 1/20 0.58
▸ SETD7 Q8WTS6 1/20 0.58

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
SCHEMBL19570148 0.93 EZH2 (0.70) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL19620827 0.85 EZH2 (0.66) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL19620961 0.85 EZH2 (0.66) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL2592674 0.84 EZH2 (0.89) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115389 0.83 EZH1 (0.72) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16115016 0.83 EZH2 (0.71) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL9286010 0.81 EZH2 (0.69) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL19621001 0.80 EZH2 (0.63) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL16680601 0.79 EZH2 (0.72) EZH2EZH1EEDSUZ12RBBP4
SCHEMBL2590359 0.79 EZH2 (0.78) EZH2EZH1EEDSUZ12RBBP4

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
Send feedback