SCHEMBL27808481

SCHEMBL27808481

O=C(/C=C/c1cc(Cl)ccc1-n1cnnn1)NC(Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1

nearest known ligand 0.88

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F11 P03951 20/20 0.88
KLKB1 P03952 19/20 0.88

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
SCHEMBL3004773 1.00 F11 (0.88) F11KLKB1
SCHEMBL3004779 1.00 F11 (0.88) F11KLKB1
SCHEMBL2994693 1.00 F11 (0.88) F11KLKB1
SCHEMBL2995053 0.95 F11 (0.79) F11KLKB1
SCHEMBL2995055 0.95 F11 (0.79) F11KLKB1
SCHEMBL3668523 0.95 F11 (0.79) F11KLKB1
SCHEMBL2995059 0.95 F11 (0.79) F11KLKB1
SCHEMBL27786650 0.94 F11 (0.89) F11KLKB1
SCHEMBL3010422 0.94 F11 (0.78) F11KLKB1
SCHEMBL3010427 0.94 F11 (0.78) F11KLKB1

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
CN-101784516-A Dipeptide analogs as coagulation factor inhibitors BRISTOL MYERS SQUIBB CO 2010-07-21 CN disclosed