SCHEMBL4392841

SCHEMBL4392841

N#Cc1cccc(-c2n[nH]c(=O)o2)c1

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 20/20 0.68

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
SCHEMBL18394315 0.81 NOTUM (1.00) NOTUM
SCHEMBL31141617 0.78 VNN1 (0.55) NOTUM
SCHEMBL3610229 0.77 NOTUM (0.67) NOTUM
SCHEMBL2291570 0.76 NOTUM (0.67) NOTUM
SCHEMBL8270247 0.76 NOTUM (1.00) NOTUM
SCHEMBL13050395 0.76 NOTUM (0.67) NOTUM
SCHEMBL18395243 0.76 NOTUM (1.00) NOTUM
SCHEMBL5542637 0.75 NOTUM (1.00) NOTUM
SCHEMBL3270146 0.74 NOTUM (0.74) NOTUM
SCHEMBL13050396 0.74 NOTUM (0.63) NOTUM

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-1959951-B1 HETEROARYL SUBSTITUTED PIPERIDINE DERIVATIVES AS L-CPT1 INHIBITORS HOFFMANN LA ROCHE (CH) 2009-12-23 EP disclosed