SCHEMBL2782307

SCHEMBL2782307

O=C1N(CC2CC2)c2ccc(NCc3ccc(Cl)c(Cl)c3)cc2C12OCCCO2

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.53
ANPEP P15144 7/20 0.46
HDAC1 Q13547 3/20 0.43
HDAC2 Q92769 3/20 0.43
POLB P06746 2/20 0.41
SCD O00767 1/20 0.39

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
SCHEMBL2781245 0.87 CNR2 (0.56) CNR2ANPEPHDAC1HDAC2POLB
SCHEMBL2781906 0.87 CNR2 (0.54) CNR2ANPEPHDAC1HDAC2POLB
SCHEMBL2781057 0.87 CNR2 (0.58) CNR2ANPEPHDAC1HDAC2POLB
SCHEMBL2781513 0.84 CNR2 (0.52) CNR2ANPEPHDAC1HDAC2POLB
SCHEMBL13196503 0.81 CNR2 (0.63) CNR2ANPEPHDAC1HDAC2POLB
SCHEMBL2782815 0.81 CNR2 (0.56) CNR2ANPEPHDAC1HDAC2POLB
SCHEMBL2781046 0.80 CNR2 (0.68) CNR2ANPEPHDAC1HDAC2POLB
SCHEMBL13196445 0.79 CNR2 (0.57) CNR2ANPEPHDAC1HDAC2POLB
SCHEMBL2780465 0.79 CNR2 (0.51) CNR2ANPEPHDAC1HDAC2POLB
SCHEMBL2780605 0.76 CNR2 (0.64) CNR2ANPEPHDAC1HDAC2POLB

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-2010090680-A1 SUBSTITUTED OXINDOLE CB2 AGONISTS WYETH LLC (US) 2010-08-12 WO claimed