SCHEMBL3373205

SCHEMBL3373205

COC(=O)Oc1cccc2c1nc(C(=O)NC1CCN(C(C)C)CC1)n2Cc1cc(-c2ccc(Cl)s2)on1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.75
F2 P00734 2/20 0.67
KLK1 P06870 1/20 0.67

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
SCHEMBL3372783 0.90 F10 (0.76) F10F2KLK1
SCHEMBL1378264 0.90 F10 (0.76) F10F2KLK1
SCHEMBL1379493 0.88 F10 (0.78) F10F2KLK1
SCHEMBL15911517 0.87 F10 (0.82) F10F2KLK1
SCHEMBL1381214 0.86 F10 (0.74) F10F2KLK1
SCHEMBL3372966 0.85 F10 (0.78) F10F2KLK1
SCHEMBL3368982 0.85 F10 (0.78) F10F2KLK1
SCHEMBL1382240 0.85 F10 (0.71) F10F2KLK1
SCHEMBL1381934 0.85 F10 (0.71) F10F2KLK1
SCHEMBL3371333 0.85 F10 (0.73) 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-1636216-B1 BENZIMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2010-07-21 EP claimed