SCHEMBL9978075

SCHEMBL9978075

CC(=O)c1cc(-c2ccc(Cl)cc2)c(OCC2CC2)nn1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 15/20 0.51
CNR2 P34972 6/20 0.49
LRRK2 Q5S007 1/20 0.40
KMO O15229 1/20 0.39
PTGER1 P34995 1/20 0.38

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
SCHEMBL411937 0.90 CNR1 (0.52) CNR1CNR2LRRK2KMO
SCHEMBL9978027 0.81 CNR1 (0.67) CNR1CNR2
SCHEMBL9978233 0.80 CNR1 (0.46) CNR1CNR2
SCHEMBL2113754 0.76 CNR1 (0.59) CNR1CNR2
SCHEMBL9934999 0.76 CNR2 (0.49) CNR1CNR2
SCHEMBL442354 0.75 CNR1 (0.67) CNR1CNR2
SCHEMBL17142128 0.73 CNR1 (0.47) CNR1CNR2KMO
SCHEMBL412180 0.73 CNR1 (0.44) CNR1CNR2
SCHEMBL30680327 0.72 CNR2 (0.66) CNR1CNR2KMOPTGER1
SCHEMBL411450 0.72 CNR2 (0.66) CNR1CNR2KMOPTGER1

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-2012080144-A1 OXIME COMPOUNDS AS HDL-CHOLESTEROL RAISING AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2012-06-21 WO disclosed