SCHEMBL3398987

SCHEMBL3398987

CC(C)(C)Cc1nc2cc(S(=O)(=O)C(C)(C)CO)cnc2n1CC1CC1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.70
CNR1 P21554 2/20 0.48

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
SCHEMBL3368019 0.87 CNR2 (0.59) CNR2CNR1
SCHEMBL3371853 0.86 CNR2 (0.71) CNR2CNR1
SCHEMBL3518084 0.84 CNR2 (0.56) CNR2CNR1
SCHEMBL3368773 0.83 CNR2 (0.54) CNR2CNR1
SCHEMBL3368195 0.82 CNR2 (1.00) CNR2CNR1
SCHEMBL4000234 0.79 CNR2 (0.59) CNR2CNR1
SCHEMBL3996721 0.77 CNR2 (0.61) CNR2CNR1
SCHEMBL3366062 0.77 CNR2 (0.47) CNR2CNR1
SCHEMBL3998389 0.77 CNR2 (0.87) CNR2CNR1
SCHEMBL3369308 0.73 CNR2 (0.43) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1994011-B1 SULFONYL BENZIMIDAZOLE DERIVATIVES RAQUALIA PHARMA INC (JP) 2010-10-13 EP disclosed