SCHEMBL4692923

SCHEMBL4692923

CC(c1ccc(Cl)cc1)C(CNC(=O)C(C)(C)Oc1ccccc1)c1cccc(Br)c1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 19/20 0.52
CNR2 P34972 11/20 0.52

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
SCHEMBL2652057 0.90 CNR1 (0.62) CNR1CNR2
SCHEMBL4688836 0.89 CNR1 (0.60) CNR1CNR2
SCHEMBL4691613 0.88 CNR1 (0.62) CNR1CNR2
SCHEMBL2653467 0.88 CNR1 (0.62) CNR1CNR2
SCHEMBL2653414 0.87 CNR1 (0.65) CNR1CNR2
SCHEMBL4690861 0.87 CNR1 (0.63) CNR1CNR2
SCHEMBL4688580 0.86 CNR1 (0.54) CNR1CNR2
SCHEMBL4692015 0.85 CNR1 (0.59) CNR1CNR2
SCHEMBL2652787 0.85 CNR1 (0.56) CNR1CNR2
SCHEMBL4688265 0.85 CNR1 (0.67) CNR1CNR2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1496838-A4 SUBSTITUTED AMIDES MERCK & CO INC (US) 2008-07-02 EP claimed
EP-1496838-A2 SUBSTITUTED AMIDES Merck & Co., Inc. (US) 2005-01-19 EP claimed
WO-2003077847-A2 SUBSTITUTED AMIDES MERCK & CO., INC. (US) 2003-09-25 WO claimed