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SCHEMBL8739014

SCHEMBL8739014

CC(=O)Nc1ccc(-c2cccc(OCc3ccc(C(=O)NC4CC(C)(C)NC(C)(C)C4)cc3)c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 9/20 0.67
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ NPC1 O15118 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ F10 P00742 1/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ ATM Q13315 1/20 0.43

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
SCHEMBL8738206 0.90 EZH2 (0.73) EZH2MEN1KMT2AL3MBTL1ATM
SCHEMBL8738150 0.89 EZH2 (0.64) EZH2MEN1KMT2ANPC1RAB9A
SCHEMBL8738653 0.88 EZH2 (0.70) EZH2MEN1KMT2AL3MBTL1ATM
SCHEMBL8738629 0.87 EZH2 (0.74) EZH2MEN1KMT2AL3MBTL1ATM
SCHEMBL8738168 0.84 EZH2 (0.67) EZH2MEN1KMT2AL3MBTL1ATM
SCHEMBL8738307 0.84 EZH2 (0.67) EZH2MEN1KMT2AL3MBTL1ATM
SCHEMBL8738204 0.84 EZH2 (0.69) EZH2MEN1KMT2AL3MBTL1ATM
SCHEMBL8738126 0.83 EZH2 (0.66) EZH2MEN1KMT2AF10L3MBTL1
SCHEMBL8738621 0.83 EZH2 (0.66) EZH2MEN1KMT2AL3MBTL1ATM
SCHEMBL8739293 0.83 EZH2 (0.68) EZH2MEN1KMT2AL3MBTL1ATM

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