SCHEMBL8738546

SCHEMBL8738546

CC1(C)CC(NC(=O)c2cccc(Oc3ccccc3)c2)CC(C)(C)N1

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 14/20 0.80
NPC1 O15118 1/20 0.68
L3MBTL1 Q9Y468 2/20 0.66
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
PKM P14618 1/20 0.65
ATM Q13315 1/20 0.60
GLA P06280 1/20 0.57

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
SCHEMBL6120964 0.89 EZH2 (1.00) EZH2L3MBTL1MEN1KMT2AATM
SCHEMBL17067333 0.88 L3MBTL1 (0.74) EZH2L3MBTL1MEN1KMT2APKM
SCHEMBL310763 0.86 KMT2A (0.82) EZH2L3MBTL1MEN1KMT2APKM
SCHEMBL8738591 0.85 EZH2 (1.00) EZH2L3MBTL1MEN1KMT2AGLA
SCHEMBL8738134 0.85 EZH2 (0.80) EZH2L3MBTL1MEN1KMT2APKM
SCHEMBL8738562 0.85 EZH2 (0.80) EZH2L3MBTL1MEN1KMT2AATM
SCHEMBL2908330 0.84 EZH2 (0.89) EZH2L3MBTL1MEN1KMT2AATM
SCHEMBL8739024 0.84 EZH2 (0.69) EZH2L3MBTL1MEN1KMT2A
SCHEMBL8738109 0.84 EZH2 (0.74) EZH2L3MBTL1MEN1KMT2AATM
SCHEMBL8739283 0.84 EZH2 (0.76) EZH2MEN1KMT2AGLA

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