SCHEMBL20548355

SCHEMBL20548355

O=C(O)NCc1c(C(=O)NN2CCCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(C#CC2CCCC2)s1

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 20/20 0.79
CNR2 P34972 20/20 0.79

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
SCHEMBL14816143 0.92 CNR1 (0.76) CNR1CNR2
SCHEMBL14825550 0.92 CNR1 (0.76) CNR1CNR2
SCHEMBL14816363 0.92 CNR1 (0.73) CNR1CNR2
SCHEMBL14816496 0.91 CNR1 (0.73) CNR1CNR2
SCHEMBL16518377 0.90 CNR1 (0.76) CNR1CNR2
SCHEMBL14833089 0.90 CNR1 (0.76) CNR1CNR2
SCHEMBL14816365 0.89 CNR1 (0.75) CNR1CNR2
SCHEMBL14816139 0.89 CNR1 (0.75) CNR1CNR2
SCHEMBL14816427 0.89 CNR1 (0.73) CNR1CNR2
SCHEMBL14816356 0.89 CNR1 (0.74) CNR1CNR2

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-2632919-B1 PYRAZOLE COMPOUNDS NATIONAL HEALTH RES INST (TW) 2018-11-07 EP disclosed