SCHEMBL8739271

SCHEMBL8739271

CNC(C)c1cccc(Oc2ccc(C(=O)NC3CC(C)(C)NC(C)(C)C3)cc2Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 17/20 0.60
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
L3MBTL1 Q9Y468 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
SCHEMBL8738990 0.88 EZH2 (0.66) EZH2MEN1KMT2A
SCHEMBL8739024 0.85 EZH2 (0.69) EZH2MEN1KMT2AL3MBTL1
SCHEMBL6119756 0.85 EZH2 (0.77) EZH2MEN1KMT2A
SCHEMBL8739265 0.83 EZH2 (0.64) EZH2MEN1KMT2A
SCHEMBL8739465 0.82 EZH2 (0.59) EZH2MEN1KMT2AL3MBTL1
SCHEMBL8738991 0.81 EZH2 (0.61) EZH2MEN1KMT2AL3MBTL1
SCHEMBL8739213 0.80 EZH2 (0.59) EZH2MEN1KMT2AL3MBTL1
SCHEMBL8739221 0.80 EZH2 (0.59) EZH2MEN1KMT2AL3MBTL1
SCHEMBL8738595 0.80 EZH2 (0.59) EZH2MEN1KMT2AL3MBTL1
SCHEMBL8738125 0.80 EZH2 (0.67) EZH2MEN1KMT2A

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