SCHEMBL4604468

SCHEMBL4604468

Cc1nc(-c2ncc(OC(=O)NC3CCN(C(C)C)CC3)n2Cc2cc(-c3ccc(Cl)s3)on2)cs1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.59
F2 P00734 1/20 0.59
KLK1 P06870 1/20 0.59

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
SCHEMBL4607485 0.88 F10 (0.63) F10F2KLK1
SCHEMBL4605782 0.87 F10 (0.65) F10F2KLK1
SCHEMBL4604319 0.86 F10 (0.63) F10F2KLK1
SCHEMBL4607996 0.86 F10 (0.58) F10F2KLK1
SCHEMBL4607055 0.86 F10 (0.61) F10F2KLK1
SCHEMBL4607856 0.85 F10 (0.62) F10F2KLK1
SCHEMBL4605283 0.85 F10 (0.62) F10F2KLK1
SCHEMBL4605987 0.85 F10 (0.60) F10F2KLK1
SCHEMBL4607254 0.84 F10 (0.61) F10F2KLK1
SCHEMBL4605751 0.84 F10 (0.61) F10F2KLK1

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-1569927-B1 IMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2008-07-16 EP claimed