SCHEMBL13406480

SCHEMBL13406480

C=C(C)c1noc(-c2nn(-c3ccc(Cl)cc3Cl)c(-c3ccc(CCCC)s3)c2C)n1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.51
CNR1 P21554 4/20 0.51

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
SCHEMBL13406481 0.88 CNR2 (0.45) CNR2CNR1
SCHEMBL8399308 0.87 CNR2 (0.51) CNR2CNR1
SCHEMBL8399425 0.86 CNR2 (0.51) CNR2CNR1
SCHEMBL8396502 0.85 CNR2 (0.50) CNR2CNR1
SCHEMBL8393421 0.81 CNR2 (0.47) CNR2CNR1
SCHEMBL8393721 0.81 CNR2 (0.47) CNR2CNR1
SCHEMBL8393722 0.80 CNR2 (0.46) CNR2CNR1
SCHEMBL13078648 0.75 CNR2 (0.68) CNR2CNR1
SCHEMBL8391090 0.74 CNR2 (0.48) CNR2
SCHEMBL3284942 0.74 CNR2 (0.48) 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
US-7705024-B2 Oxadiazole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2010-04-27 US disclosed