SCHEMBL7299057

SCHEMBL7299057

N=C(N)c1ccc(NC(=O)c2ccc3c(c2)C=C(CC(=O)O)CC3)cc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 12/20 0.54
ITGA2B P08514 12/20 0.54
PLAU P00749 6/20 0.50
PLG P00747 5/20 0.45
KLKB1 P03952 5/20 0.45
PRSS1 P07477 5/20 0.45
F2 P00734 4/20 0.45
PLAT P00750 4/20 0.45
KLK1 P06870 1/20 0.45

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
SCHEMBL7306559 0.94 ITGB3 (0.55) ITGB3ITGA2BPLAUPLGKLKB1
SCHEMBL7299756 0.89 ITGB3 (0.47) ITGB3ITGA2BPLAU
SCHEMBL7305850 0.88 PLAU (0.47) ITGB3ITGA2BPLAUPLGKLKB1
SCHEMBL7308827 0.86 LMNA (0.47) ITGB3ITGA2BPLAUPLGKLKB1
SCHEMBL7301801 0.83 PLAU (0.48) ITGB3ITGA2BPLAUPLGKLKB1
SCHEMBL7309377 0.81 PLAU (0.47) ITGB3ITGA2BPLAUF2PLAT
SCHEMBL7307859 0.81 CYP26A1 (0.50) PLAUPLGKLKB1PRSS1PLAT
SCHEMBL7299794 0.76 ITGB3 (0.56) ITGB3ITGA2BPRSS1F2KLK1
SCHEMBL7430798 0.73 PLAU (0.76) ITGB3ITGA2BPLAUPLGKLKB1
Hydrochloric Acid SCHEMBL8994029 0.72 F2 (0.71) PLAUPLGKLKB1PRSS1F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0709370-B1 Bicyclic compounds useful as platelet aggregation inhibitors MITSUI CHEMICALS INC (JP) 1999-01-13 EP disclosed
US-5629321-A FIBRINOGEN ANTAGONIST MITSUI TOATSU CHEMICALS, INC. (JP) 1997-05-13 US disclosed
EP-0709370-A1 Bicyclic compounds useful as platelet aggregation inhibitors MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-05-01 EP disclosed