SCHEMBL19610318

SCHEMBL19610318

CCCn1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(-c3ccc(N4CCN(CC)CC4)nc3)cc21

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 12/20 0.71
▸ EZH1 Q92800 5/20 0.71
▸ EED O75530 6/20 0.66
▸ SUZ12 Q15022 6/20 0.66
▸ HDAC6 Q9UBN7 6/20 0.65
▸ HDAC1 Q13547 4/20 0.63
▸ RBBP4 Q09028 1/20 0.61
▸ RBBP7 Q16576 1/20 0.61
▸ AEBP2 Q6ZN18 1/20 0.61

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
SCHEMBL19657082 0.92 EZH2 (0.78) EZH2EZH1EEDSUZ12HDAC6
SCHEMBL19610320 0.91 EZH2 (0.68) EZH2EZH1EEDSUZ12HDAC6
SCHEMBL12180090 0.89 EZH2 (0.87) EZH2EZH1EEDSUZ12HDAC6
SCHEMBL19610327 0.86 EZH2 (0.73) EZH2EZH1EEDSUZ12HDAC6
SCHEMBL19610153 0.86 EZH2 (0.82) EZH2EZH1EEDSUZ12HDAC6
SCHEMBL19610202 0.85 EZH2 (0.60) EZH2EZH1EEDSUZ12HDAC6
SCHEMBL19610316 0.85 EZH2 (0.58) EZH2EZH1EEDSUZ12HDAC6
SCHEMBL19610196 0.84 EZH2 (0.59) EZH2EZH1EEDSUZ12HDAC6
SCHEMBL19477604 0.84 EZH2 (0.67) EZH2EZH1EEDSUZ12HDAC6
SCHEMBL2592203 0.84 EZH2 (0.76) EZH2EZH1EEDSUZ12HDAC6

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 claimed
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