SCHEMBL4552471

SCHEMBL4552471

CC(=O)OC1CN(S(=O)(=O)c2ccc3c(c2)nc(C(C)(C)C)n3CC2CCC(F)(F)CC2)C1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.58
CNR1 P21554 3/20 0.58
KCNH2 Q12809 1/20 0.54

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
SCHEMBL1610017 0.90 CNR2 (0.57) CNR2CNR1KCNH2
SCHEMBL1609361 0.88 CNR2 (0.63) CNR2CNR1KCNH2
SCHEMBL1608905 0.87 CNR2 (0.64) CNR2CNR1KCNH2
SCHEMBL1609301 0.87 CNR2 (0.59) CNR2CNR1KCNH2
SCHEMBL1608949 0.86 CNR2 (0.63) CNR2CNR1KCNH2
SCHEMBL12713963 0.85 CNR2 (0.62) CNR2CNR1KCNH2
SCHEMBL1609170 0.85 CNR2 (0.59) CNR2CNR1KCNH2
SCHEMBL1610049 0.85 CNR2 (0.59) CNR2CNR1KCNH2
SCHEMBL4551525 0.84 CNR2 (0.67) CNR2CNR1KCNH2
SCHEMBL1609630 0.84 CNR2 (0.65) CNR2CNR1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2010526-A1 BENZIMIDAZOLE 5-SULFONAMIDE DERIVATIVES AS CANNABINOID 1 (CB1) RECEPTOR LIGANDS AstraZeneca AB (SE) 2009-01-07 EP disclosed
WO-2007120101-A1 BENZIMIDAZOLE 5-SULFONAMIDE DERIVATIVES AS CANNABINOID 1 (CB1) RECEPTOR LIGANDS ASTRAZENECA AB (SE) 2007-10-25 WO disclosed