SCHEMBL1990290

SCHEMBL1990290

Cc1c(OC(=O)O)nn(-c2ccc(Cl)cc2Cl)c1-c1cc(Br)cs1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.44
CNR1 P21554 10/20 0.44
LMNA P02545 1/20 0.42

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
SCHEMBL1985199 0.92 LMNA (0.44) CNR2CNR1LMNA
SCHEMBL1987373 0.91 CNR2 (0.43) CNR2CNR1LMNA
SCHEMBL1984640 0.87 CNR1 (0.46) CNR2CNR1LMNA
SCHEMBL1983442 0.86 MAPT (0.37) CNR1LMNA
SCHEMBL1984047 0.86 CNR2 (0.59) CNR2CNR1LMNA
SCHEMBL1985983 0.84 CNR2 (0.50) CNR2CNR1LMNA
SCHEMBL1985179 0.84 CNR2 (0.54) CNR2CNR1
SCHEMBL1985913 0.83 CNR2 (0.59) CNR2CNR1LMNA
SCHEMBL8779197 0.82 CNR2 (0.61) CNR2CNR1
SCHEMBL1989275 0.79 CNR2 (0.43) CNR2CNR1LMNA

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-1602656-B1 PYRAZOLE DERIVATIVES HAVING AFFINITY FOR CB1 AND/OR CB2 RECEPTORS NEUROSCIENZE PHARMANESS S C A R L (IT) 2011-06-29 EP claimed