SCHEMBL3371273

SCHEMBL3371273

O=C(Nc1ccc(N2CCNCC2=O)cc1)Oc1nc2ccccc2n1Cc1cc(-c2ccc(Cl)s2)on1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.46
F2 P00734 8/20 0.42
KLK1 P06870 2/20 0.41
PLAT P00750 1/20 0.41

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
SCHEMBL1378392 0.88 F10 (0.56) F10F2KLK1
SCHEMBL3374323 0.87 F10 (0.48) F10F2KLK1PLAT
SCHEMBL3369976 0.85 F10 (0.49) F10F2KLK1PLAT
SCHEMBL3371355 0.85 F10 (0.48) F10F2KLK1PLAT
SCHEMBL3367383 0.84 F10 (0.46) F10F2KLK1PLAT
SCHEMBL3367502 0.83 F10 (0.48) F10F2KLK1PLAT
SCHEMBL3368146 0.82 F10 (0.46) F10F2KLK1PLAT
SCHEMBL3368156 0.75 F10 (0.50) F10
SCHEMBL3372764 0.73 F10 (0.77) F10F2KLK1
SCHEMBL3369647 0.73 F10 (0.53) F10F2KLK1PLAT

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