SCHEMBL8947853

SCHEMBL8947853

CCOC(=O)CCN(C(=O)[C@H](CC(=O)NCC1CN(C(=N)NC(=O)OCC)CCO1)NS(=O)(=O)c1ccc2ccccc2c1)C1CC1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 14/20 0.49
PLAU P00749 1/20 0.40
PLAT P00750 1/20 0.40
PLG P00747 1/20 0.38

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
SCHEMBL8947709 0.96 F2 (0.48) F2PLAUPLATPLG
SCHEMBL8947615 0.92 F2 (0.49) F2PLAUPLATPLG
SCHEMBL8947601 0.89 F2 (0.62) F2
SCHEMBL7308142 0.87 F2 (0.46) F2PLAUPLAT
SCHEMBL8926961 0.86 F2 (0.49) F2PLAUPLATPLG
SCHEMBL7306791 0.84 F2 (0.41) F2PLAUPLATPLG
Trifluoroacetic Acid SCHEMBL8948194 0.84 F2 (0.46) F2PLAUPLAT
SCHEMBL7306798 0.83 F2 (0.45) F2
SCHEMBL8947945 0.81 F2 (0.73) F2
Hydrochloric Acid SCHEMBL8947930 0.81 F2 (0.74) F2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5578594-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1996-11-26 US disclosed
US-5405854-A Anticoagulants HOFFMANN-LA ROCHE INC. (US) 1995-04-11 US disclosed