SCHEMBL2771608

SCHEMBL2771608

Cc1c(CO)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Br)cc1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.63
OPRL1 P41146 6/20 0.60
KCNH2 Q12809 2/20 0.60
CNR2 P34972 2/20 0.56

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
SCHEMBL3390751 0.93 OPRL1 (0.69) CNR1OPRL1KCNH2CNR2
SCHEMBL2770316 0.89 OPRL1 (0.61) CNR1OPRL1KCNH2CNR2
SCHEMBL2768949 0.88 OPRL1 (0.60) CNR1OPRL1KCNH2CNR2
Hydrochloric Acid SCHEMBL5384239 0.87 OPRL1 (0.59) CNR1OPRL1KCNH2CNR2
SCHEMBL2769826 0.86 CNR1 (0.59) CNR1KCNH2CNR2
SCHEMBL15392497 0.85 CNR2 (0.57) CNR1OPRL1KCNH2CNR2
SCHEMBL5388303 0.81 CNR2 (0.67) CNR1CNR2
SCHEMBL4845608 0.81 OPRL1 (0.70) CNR1OPRL1KCNH2CNR2
SCHEMBL2769818 0.81 OPRL1 (0.70) CNR1OPRL1KCNH2CNR2
SCHEMBL2769539 0.80 OPRL1 (0.69) CNR1OPRL1KCNH2CNR2

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-1720837-B1 DERIVATIVES OF N-' (1,5-DIPHENYL-1H-PYRAZOL-3-YL) SULPHONAMIDE WITH CB1 RECEPTOR AFFINITY SANOFI AVENTIS (FR) 2010-04-28 EP disclosed
EP-1720837-A1 DERIVATIVES OF N-' (1,5-DIPHENYL-1H-PYRAZOL-3-YL) SULPHONAMIDE WITH CB1 RECEPTOR AFFINITY Sanofi-Aventis (FR) 2006-11-15 EP disclosed
WO-2005073197-A1 DERIVATIVES OF N-` (1,5-DIPHENYL-1H-PYRAZOL-3-YL) SULPHONAMIDE WITH CB1 RECEPTOR AFFINITY SANOFI-AVENTIS (FR) 2005-08-11 WO disclosed