SCHEMBL8904679

SCHEMBL8904679

N=C(N)c1ccc2c(C(=O)Nc3ccc(CCC(=O)O)cc3)occ2c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLAU P00749 10/20 0.50
PLG P00747 9/20 0.50
PRSS1 P07477 8/20 0.50
PLAT P00750 8/20 0.50
F2 P00734 7/20 0.50
ITGB3 P05106 7/20 0.50
ITGA2B P08514 7/20 0.50
KLKB1 P03952 5/20 0.50
NR1H4 Q96RI1 1/20 0.46
KLK1 P06870 5/20 0.46
ITGB1 P05556 1/20 0.45
ITGAV P06756 1/20 0.45
ITGB5 P18084 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
SCHEMBL8904886 0.89 PLAU (0.49) PLAUPLGPRSS1PLATF2
SCHEMBL8904848 0.86 PLAU (0.48) PLAUPLGPRSS1PLATF2
SCHEMBL8903312 0.85 PLAU (0.47) PLAUPLGPRSS1PLATF2
SCHEMBL8903828 0.82 MEN1 (0.48) PLAUPLGPRSS1PLATF2
SCHEMBL8906154 0.82 ITGB3 (0.47) PLAUPLGPRSS1PLATF2
SCHEMBL8904666 0.80 ITGB3 (0.62) PLAUPLGPRSS1PLATF2
SCHEMBL8903880 0.78 F2 (0.41) PLAUPLGPRSS1PLATF2
SCHEMBL8903960 0.77 F2 (0.47) PLAUPLGPRSS1PLATF2
SCHEMBL8903982 0.77 PLAU (0.42) PLAUPLGPRSS1PLATF2
SCHEMBL8903869 0.76 ITGB3 (0.54) PLAUPLGPRSS1PLATF2

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-5635527-A ANTAGONIST OF PLATELET MEMBRANE GLYCOPROTEIN; TREATMENT OF THROMBOTIC DISEASES THE GREEN CROSS CORPORATION (JP) 1997-06-03 US disclosed
EP-0712844-A1 NOVEL FUSED-RING CARBOXYLIC ACID COMPOUND OR SALT THEREOF, AND MEDICINAL USE THEREOF THE GREEN CROSS CORPORATION (JP) 1996-05-22 EP disclosed