SCHEMBL3372803

SCHEMBL3372803

CN1C2CCC1CC(NC(=O)Oc1nc3ccccc3n1Cc1cc(-c3ccc(Cl)s3)on1)C2

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.60
F2 P00734 6/20 0.55
KLK1 P06870 1/20 0.53

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
SCHEMBL3372764 0.88 F10 (0.77) F10F2KLK1
SCHEMBL3374228 0.82 F10 (0.72) F10F2KLK1
SCHEMBL3369778 0.77 F10 (0.70) F10F2KLK1
SCHEMBL15911283 0.77 F10 (0.79) F10F2KLK1
SCHEMBL15911511 0.76 F10 (0.79) F10F2KLK1
SCHEMBL3371355 0.76 F10 (0.48) F10F2KLK1
SCHEMBL3369976 0.76 F10 (0.49) F10F2KLK1
SCHEMBL3371040 0.75 F10 (0.59) F10F2KLK1
SCHEMBL3369769 0.75 F10 (0.59) F10F2KLK1
SCHEMBL3371482 0.75 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-1636216-B1 BENZIMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2010-07-21 EP claimed