Sugi Predict

Sugi Predict / Compounds / SCHEMBL19503336

SCHEMBL19503336

SCHEMBL19503336

C=CC(=O)N(c1cc(C(=O)NCC2=CNNN2)cc(-c2ccc(N3CCN(C)CC3)nc2)c1)C1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 18/20 0.46
▸ HDAC1 Q13547 2/20 0.40
▸ HDAC6 Q9UBN7 2/20 0.40
▸ EED O75530 4/20 0.37
▸ SUZ12 Q15022 4/20 0.37
▸ RBBP4 Q09028 2/20 0.37
▸ AEBP2 Q6ZN18 2/20 0.37
▸ EZH1 Q92800 2/20 0.35
▸ RBBP7 Q16576 1/20 0.35

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
SCHEMBL19503340 0.86 EZH2 (0.47) EZH2HDAC1HDAC6EEDSUZ12
SCHEMBL19503338 0.86 EZH2 (0.45) EZH2HDAC1HDAC6
SCHEMBL19503495 0.85 EZH2 (0.46) EZH2HDAC1HDAC6EEDSUZ12
SCHEMBL19503339 0.85 EZH2 (0.46) EZH2HDAC1HDAC6EEDSUZ12
SCHEMBL19503331 0.85 EZH2 (0.46) EZH2HDAC1HDAC6EEDSUZ12
SCHEMBL19503335 0.85 EZH2 (0.48) EZH2HDAC1HDAC6EEDSUZ12
SCHEMBL19503908 0.84 EZH2 (0.44) EZH2HDAC1HDAC6
SCHEMBL19503275 0.83 EZH2 (0.55) EZH2HDAC1HDAC6EEDSUZ12
SCHEMBL19503266 0.82 EZH2 (0.69) EZH2HDAC1HDAC6EEDSUZ12
SCHEMBL19503333 0.79 EZH2 (0.46) EZH2HDAC1HDAC6EZH1

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
WO-2017184999-A1 EZH2 INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-10-26 — — WO disclosed
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