SCHEMBL8739385

SCHEMBL8739385

Cc1cc(C(=O)NC2CC(C)(C)NC(C)(C)C2)ccc1Oc1cccc(C2CC2)c1C#N

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 18/20 0.71
GLA P06280 1/20 0.53
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL8739046 0.87 EZH2 (0.73) EZH2GLAMEN1KMT2A
SCHEMBL8738255 0.86 EZH2 (0.77) EZH2MEN1KMT2A
SCHEMBL8738587 0.85 EZH2 (0.73) EZH2GLA
SCHEMBL8739467 0.85 EZH2 (0.76) EZH2MEN1KMT2A
SCHEMBL8739257 0.83 EZH2 (1.00) EZH2MEN1KMT2A
SCHEMBL8739025 0.82 EZH2 (0.65) EZH2
SCHEMBL8738930 0.82 EZH2 (0.84) EZH2
SCHEMBL8739078 0.82 EZH2 (0.84) EZH2
SCHEMBL8739744 0.80 EZH2 (1.00) EZH2MEN1KMT2A
SCHEMBL8738656 0.80 EZH2 (0.81) 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