SCHEMBL8739073

SCHEMBL8739073

CC1(C)CC(NC(=O)c2ccc(COc3cccc4c3CCCC4)cc2)CC(C)(C)N1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 14/20 0.65
RXRA P19793 5/20 0.57
RXRB P28702 4/20 0.57
RXRG P48443 3/20 0.57
MRGPRX4 Q96LA9 1/20 0.50

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
SCHEMBL8738585 0.86 EZH2 (0.70) EZH2
SCHEMBL8738688 0.85 EZH2 (0.69) EZH2
SCHEMBL8738171 0.85 EZH2 (0.74) EZH2RXRARXRBRXRG
SCHEMBL8738114 0.82 EZH2 (0.70) EZH2
SCHEMBL8738586 0.82 EZH2 (0.73) EZH2
SCHEMBL8738184 0.81 EZH2 (0.72) EZH2
SCHEMBL8739739 0.81 EZH2 (0.73) EZH2
SCHEMBL8738276 0.80 EZH2 (0.64) EZH2
SCHEMBL8738568 0.79 EZH2 (0.66) EZH2
SCHEMBL8738997 0.79 EZH2 (1.00) 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