SCHEMBL4620149

SCHEMBL4620149

Cc1nc(-c2ccccc2)n(Cc2cc(-c3ccc(Cl)s3)on2)c1C(=O)NC1CCN(C(C)C)CC1

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.74
F2 P00734 1/20 0.70
KLK1 P06870 1/20 0.70

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
SCHEMBL4608112 0.88 F10 (0.64) F10F2KLK1
SCHEMBL4606533 0.85 F10 (0.64) F10F2KLK1
SCHEMBL1675170 0.85 F10 (1.00) F10F2KLK1
SCHEMBL4607044 0.85 F10 (0.64) F10F2KLK1
SCHEMBL1674996 0.83 F10 (0.88) F10F2KLK1
SCHEMBL1674962 0.83 F10 (1.00) F10F2KLK1
SCHEMBL6278691 0.83 F10 (0.59) F10F2KLK1
SCHEMBL1675507 0.82 F10 (1.00) F10F2KLK1
SCHEMBL4605394 0.82 F10 (0.50) F10F2KLK1
SCHEMBL8358940 0.82 F10 (1.00) 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 disclosed