SCHEMBL14155477

SCHEMBL14155477

O=C(NN1CCCC1)c1cc(-c2ccc(C3CC3)cc2)n(-c2ccc(Cl)cc2Cl)n1

nearest known ligand 0.98

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.81
CNR2 P34972 7/20 0.58
RPA1 P27694 1/20 0.54

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
SCHEMBL14155480 0.99 CNR1 (0.83) CNR1CNR2
SCHEMBL5157539 0.90 CNR1 (1.00) CNR1CNR2RPA1
SCHEMBL4613969 0.87 CNR1 (0.90) CNR1CNR2RPA1
SCHEMBL5154664 0.86 CNR1 (0.88) CNR1CNR2RPA1
SCHEMBL14155455 0.80 CNR1 (0.82) CNR1CNR2
SCHEMBL14155469 0.80 CNR1 (0.84) CNR1CNR2
SCHEMBL7351242 0.78 CNR1 (0.68) CNR1RPA1
SCHEMBL14155483 0.78 CNR1 (0.81) CNR1CNR2
SCHEMBL3087783 0.78 CNR1 (0.73) CNR1CNR2
Hydrochloric Acid SCHEMBL9155041 0.78 CNR1 (0.67) CNR1RPA1

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
WO-2008075118-A1 NOVEL CB1 ANTAGONISTS AND THEIR PREPARATION RICHTER GEDEON NYRT. (HU) 2008-06-26 WO disclosed