SCHEMBL19390963

SCHEMBL19390963

CCN(c1cc(Cl)cc(C(=O)NC/C(C(N)=O)=C(\C)NC)c1C)[C@H]1CC[C@H](N(C)Cc2cccc(OCCOC)c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 20/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41

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
SCHEMBL19390977 0.93 EZH2 (0.42) EZH2
SCHEMBL19391031 0.88 EZH2 (0.42) EZH2
SCHEMBL19390956 0.85 EZH2 (0.47) EZH2
SCHEMBL19390905 0.81 EZH2 (0.42) EZH2
SCHEMBL15839055 0.80 EZH2 (0.54) EZH2CYP2D6CYP2C19
SCHEMBL15839065 0.80 EZH2 (0.54) EZH2CYP2D6CYP2C19
SCHEMBL19391212 0.79 EZH2 (0.63) EZH2CYP2D6CYP2C19
SCHEMBL16408169 0.79 EZH2 (0.52) EZH2CYP2D6CYP2C19
SCHEMBL16398235 0.79 EZH2 (0.52) EZH2CYP2D6CYP2C19
SCHEMBL16402311 0.79 EZH2 (0.52) EZH2CYP2D6CYP2C19

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-3022184-B1 SUBSTITUTED BENZENE COMPOUNDS EPIZYME INC (US) 2017-09-27 — — EP disclosed
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