SCHEMBL4694500

SCHEMBL4694500

CC(c1ccccc1)C(CNC(=O)C(C)(C)Oc1ccc(F)cc1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 17/20 0.58
CNR2 P34972 10/20 0.49
PRMT5 O14744 1/20 0.42
WDR77 Q9BQA1 1/20 0.42
ADRB3 P13945 2/20 0.42

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
SCHEMBL4692569 0.95 CNR1 (0.53) CNR1CNR2
SCHEMBL4691557 0.94 CNR1 (0.65) CNR1CNR2
SCHEMBL4687849 0.94 CNR1 (0.52) CNR1CNR2
SCHEMBL4692000 0.94 CNR1 (0.65) CNR1CNR2
SCHEMBL4694395 0.94 CNR1 (0.65) CNR1CNR2
SCHEMBL4691059 0.89 CNR1 (0.64) CNR1CNR2
SCHEMBL4692540 0.89 CNR1 (0.64) CNR1CNR2
SCHEMBL4687817 0.88 CNR1 (0.54) CNR1CNR2
SCHEMBL4690861 0.88 CNR1 (0.63) CNR1CNR2
SCHEMBL4691613 0.87 CNR1 (0.62) 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 6 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
EP-1496838-A4 SUBSTITUTED AMIDES MERCK & CO INC (US) 2008-07-02 EP disclosed
EP-1496838-A2 SUBSTITUTED AMIDES Merck & Co., Inc. (US) 2005-01-19 EP disclosed
WO-2003077847-A2 SUBSTITUTED AMIDES MERCK & CO., INC. (US) 2003-09-25 WO disclosed