SCHEMBL5723939

SCHEMBL5723939

CO[C@@H]1C[C@H](C(=O)Nc2ccc(-n3c(OC(=O)O)cccc3=O)cc2F)N(C(=O)Nc2ccc(Cl)cc2)C1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.73
KLKB1 P03952 1/20 0.50

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
SCHEMBL3832123 0.90 F10 (0.75) F10KLKB1
SCHEMBL3832129 0.90 F10 (0.75) F10KLKB1
SCHEMBL3832089 0.89 F10 (0.78) F10KLKB1
SCHEMBL3830577 0.89 F10 (0.78) F10KLKB1
SCHEMBL5724581 0.89 F10 (0.59) F10KLKB1
SCHEMBL3832075 0.88 F10 (0.75) F10KLKB1
SCHEMBL3832083 0.88 F10 (0.75) F10KLKB1
SCHEMBL3833612 0.87 F10 (0.74) F10KLKB1
SCHEMBL5724088 0.86 F10 (0.67) F10KLKB1
SCHEMBL5724801 0.86 F10 (0.67) F10KLKB1

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-1465864-B1 INHIBITORS OF FACTOR XA AND OTHER SERINE PROTEASES INVOLVED IN THE COAGULATION CASCADE WARNER LAMBERT CO (US) 2006-03-15 EP claimed