SCHEMBL844625

SCHEMBL844625

CCCCOC(=O)Oc1c(C)cc2nc(CO)n(-c3ccccc3S(=O)(=O)NC)c(=O)c2c1C

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.57
CNR2 P34972 1/20 0.57
AGTR2 P50052 5/20 0.34
AGTR1 P30556 4/20 0.34
ELANE P08246 1/20 0.33

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
SCHEMBL844232 0.88 CNR1 (0.69) CNR1CNR2AGTR2AGTR1
SCHEMBL844370 0.85 CNR1 (0.75) CNR1CNR2
SCHEMBL844881 0.83 CNR1 (0.69) CNR1CNR2
SCHEMBL845014 0.83 CNR1 (0.80) CNR1CNR2
SCHEMBL844571 0.81 CNR1 (0.79) CNR1CNR2
SCHEMBL17694535 0.74 CNR1 (0.79) CNR1CNR2
SCHEMBL17692331 0.73 CNR1 (0.90) CNR1CNR2
SCHEMBL844334 0.73 CNR1 (0.68) CNR1CNR2
SCHEMBL844174 0.73 CNR1 (0.87) CNR1CNR2
SCHEMBL17692388 0.72 CNR1 (0.86) 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-1472234-B1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS CB AGONISTS NOVARTIS AG (CH) 2012-03-28 EP claimed