SCHEMBL3390052

SCHEMBL3390052

CC[C@H](C)[C@H](NC(=O)n1c(=O)n(CCN2CCOCC2)c2ccccc21)C(=O)O

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 17/20 0.84
CNR1 P21554 5/20 0.62

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
SCHEMBL3390046 1.00 CNR2 (0.84) CNR2CNR1
Hydrochloric Acid SCHEMBL735926 0.99 CNR2 (0.82) CNR2CNR1
Hydrochloric Acid SCHEMBL735927 0.99 CNR2 (0.82) CNR2CNR1
SCHEMBL764329 0.91 CNR2 (1.00) CNR2CNR1
SCHEMBL738471 0.91 CNR2 (1.00) CNR2CNR1
SCHEMBL736400 0.90 CNR2 (0.81) CNR2CNR1
SCHEMBL736401 0.90 CNR2 (0.81) CNR2CNR1
Hydrochloric Acid SCHEMBL739303 0.90 CNR2 (0.98) CNR2CNR1
SCHEMBL762508 0.90 CNR2 (0.81) CNR2CNR1
Hydrochloric Acid SCHEMBL737344 0.90 CNR2 (0.98) 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
EP-1861377-B1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS PFIZER (US) 2010-12-29 EP disclosed