SCHEMBL8316397

SCHEMBL8316397

Cc1cc(NC(=O)[C@@H](CS(C)(=O)=O)NC(=O)C2CC=C(Cl)S2)ccc1N1CCOCC1=O

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.57

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
SCHEMBL1405949 0.82 F10 (0.63) F10
SCHEMBL4027287 0.81 F10 (0.84) F10
SCHEMBL4035484 0.81 F10 (0.84) F10
SCHEMBL13755809 0.81 F10 (0.84) F10
SCHEMBL4001280 0.76 F10 (0.70) F10
SCHEMBL8321142 0.75 F10 (0.52) F10
SCHEMBL1405825 0.74 F10 (0.67) F10
SCHEMBL1405803 0.73 F10 (0.62) F10
SCHEMBL5218323 0.73 F10 (0.57) F10
SCHEMBL2471760 0.72 F10 (1.00) F10

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-2004046138-A1 CARBOXAMIDES MERCK PATENT GMBH (DE) 2004-06-03 WO disclosed