SCHEMBL8739739

SCHEMBL8739739

CC1(C)CC(NC(=O)c2ccc(COc3ccccc3C#N)cc2)CC(C)(C)N1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 20/20 0.73

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
SCHEMBL8738171 0.85 EZH2 (0.74) EZH2
SCHEMBL8738586 0.85 EZH2 (0.73) EZH2
SCHEMBL8738559 0.85 EZH2 (1.00) EZH2
SCHEMBL8738114 0.83 EZH2 (0.70) EZH2
SCHEMBL8738594 0.82 EZH2 (0.77) EZH2
SCHEMBL8738997 0.82 EZH2 (1.00) EZH2
SCHEMBL8738935 0.82 EZH2 (1.00) EZH2
SCHEMBL8738688 0.82 EZH2 (0.69) EZH2
SCHEMBL8739073 0.81 EZH2 (0.65) EZH2
SCHEMBL8739042 0.81 EZH2 (1.00) EZH2

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-2012068589-A2 MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF CONSTELLATION PHARMACEUTICALS (US) 2012-05-24 WO disclosed