SCHEMBL5202590

SCHEMBL5202590

CC(CCCNC(=O)C1CCC1)[C@H](Cc1ccc(Cl)cc1)c1cccc(C#N)c1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 20/20 0.57
CNR2 P34972 14/20 0.57

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
SCHEMBL5233690 0.95 CNR1 (0.57) CNR1CNR2
SCHEMBL5203969 0.89 CNR1 (0.58) CNR1CNR2
SCHEMBL14064715 0.86 CNR1 (0.71) CNR1CNR2
SCHEMBL4829850 0.86 CNR1 (0.71) CNR1CNR2
SCHEMBL5233684 0.84 CNR1 (0.64) CNR1CNR2
SCHEMBL5201372 0.79 CNR1 (0.49) CNR1CNR2
SCHEMBL5206124 0.78 CNR1 (0.57) CNR1CNR2
SCHEMBL5203386 0.78 CNR1 (0.57) CNR1CNR2
SCHEMBL5202892 0.77 CNR1 (0.51) CNR1CNR2
SCHEMBL5203483 0.76 CNR1 (0.55) 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-1490043-A4 SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO INC (US) 2007-05-30 EP claimed
EP-1490043-A2 SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS Merck & Co., Inc. (US) 2004-12-29 EP claimed
WO-2003082190-A2 SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO., INC. (US) 2003-10-09 WO claimed
EP-1490043-A4 SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO INC (US) 2007-05-30 EP disclosed
EP-1490043-A2 SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS Merck & Co., Inc. (US) 2004-12-29 EP disclosed
WO-2003082190-A2 SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO., INC. (US) 2003-10-09 WO disclosed