SCHEMBL4085194

SCHEMBL4085194

CC(CS(=O)(=O)Nc1ccc2c(c1)nc(C(C)(C)C)n2CC1CCOCC1)NCCO

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.59
CNR1 P21554 5/20 0.58

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
SCHEMBL4085426 0.85 CNR2 (0.62) CNR2CNR1
SCHEMBL4074543 0.84 CNR2 (0.61) CNR2CNR1
SCHEMBL4088602 0.84 CNR2 (0.60) CNR2CNR1
SCHEMBL4073532 0.83 CNR2 (0.59) CNR2CNR1
SCHEMBL4074522 0.80 CNR2 (0.64) CNR2CNR1
SCHEMBL3917596 0.79 CNR2 (0.65) CNR2CNR1
SCHEMBL4966392 0.78 CNR2 (0.66) CNR2CNR1
SCHEMBL5722214 0.77 CNR2 (0.59) CNR2CNR1
SCHEMBL585121 0.77 CNR2 (0.66) CNR2CNR1
SCHEMBL3926323 0.76 CNR2 (0.63) CNR2CNR1

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-1670769-B1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2009-04-29 EP claimed
EP-1670769-A1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF AstraZeneca AB (SE) 2006-06-21 EP claimed
WO-2005030732-A1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2005-04-07 WO claimed