SCHEMBL4056091

SCHEMBL4056091

CC(C)(C)[C@H](NC(=O)c1nn(CCCCC#N)c2ccc(Cl)cc12)C(N)=O

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 13/20 0.59
CNR2 P34972 11/20 0.59
RAB9A P51151 1/20 0.35

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
SCHEMBL13690956 0.92 CNR1 (0.48) CNR1CNR2RAB9A
SCHEMBL4051609 0.92 CNR1 (0.48) CNR1CNR2RAB9A
SCHEMBL4057370 0.90 CNR1 (0.47) CNR1CNR2
SCHEMBL4052822 0.90 CNR1 (0.60) CNR1CNR2
SCHEMBL4054772 0.90 CNR1 (0.48) CNR1CNR2
SCHEMBL4057194 0.88 CNR1 (0.60) CNR1CNR2RAB9A
SCHEMBL4049934 0.87 CNR1 (0.45) CNR1CNR2RAB9A
SCHEMBL4054847 0.87 CNR1 (0.78) CNR1CNR2
SCHEMBL13691236 0.86 CNR1 (0.44) CNR1CNR2
SCHEMBL4049656 0.86 CNR1 (0.44) 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
WO-2009106980-A2 INDAZOLE DERIVATIVES PFIZER INC. (US) 2009-09-03 WO claimed