SCHEMBL8738150

SCHEMBL8738150

CC(=O)Nc1ccc(-c2cccc(OCc3ccc(C(=O)NC4CC(C)(C)NC(C)(C)C4)cc3)c2)cn1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 12/20 0.64
L3MBTL1 Q9Y468 2/20 0.45
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ABL1 P00519 1/20 0.42
BCR P11274 1/20 0.42
ATM Q13315 1/20 0.41
GLA P06280 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
SCHEMBL8739266 0.93 EZH2 (0.62) EZH2L3MBTL1NPC1RAB9AKMT2A
SCHEMBL8739014 0.89 EZH2 (0.67) EZH2L3MBTL1NPC1RAB9AMEN1
SCHEMBL8738307 0.89 EZH2 (0.67) EZH2L3MBTL1MEN1KMT2AATM
SCHEMBL8738621 0.88 EZH2 (0.66) EZH2L3MBTL1MEN1KMT2AATM
SCHEMBL8738126 0.88 EZH2 (0.66) EZH2L3MBTL1MEN1KMT2AATM
SCHEMBL8738209 0.87 EZH2 (0.65) EZH2L3MBTL1MEN1KMT2AATM
SCHEMBL8739045 0.87 EZH2 (0.64) EZH2L3MBTL1MEN1KMT2AATM
SCHEMBL8739018 0.86 EZH2 (0.68) EZH2L3MBTL1MEN1KMT2AATM
SCHEMBL8738211 0.86 EZH2 (0.68) EZH2L3MBTL1MEN1KMT2AATM
SCHEMBL8738206 0.86 EZH2 (0.73) EZH2L3MBTL1MEN1KMT2AATM

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