SCHEMBL8713085

SCHEMBL8713085

CCCCS(=O)(=O)NC(Cc1ccc(NC(=O)c2cc3cc(C(=N)N)ccc3o2)cc1)C(=O)OC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 13/20 0.60
ITGA2B P08514 13/20 0.60
PLG P00747 3/20 0.43
PLAU P00749 3/20 0.43
PLAT P00750 3/20 0.43
KLKB1 P03952 3/20 0.43
PRSS1 P07477 3/20 0.43
F2 P00734 2/20 0.43
MAPT P10636 3/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP3 P42574 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
TP53 P04637 1/20 0.39

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
SCHEMBL8905568 0.92 ITGB3 (0.68) ITGB3ITGA2BPLGPLAUPLAT
SCHEMBL8903850 0.92 ITGB3 (0.68) ITGB3ITGA2BPLGPLAUPLAT
SCHEMBL8712774 0.85 ITGB3 (0.43) ITGB3ITGA2BMAPTMEN1NPC1
SCHEMBL8904310 0.85 ITGB3 (0.47) ITGB3ITGA2BPLGPLAUPLAT
SCHEMBL8716564 0.84 ITGB3 (0.56) ITGB3ITGA2BPLGPLAUPLAT
SCHEMBL9052307 0.81 ITGB3 (0.52) ITGB3ITGA2BMAPTMEN1NPC1
SCHEMBL8712842 0.77 ITGB3 (0.53) ITGB3ITGA2BPLGPLAUPLAT
SCHEMBL8903869 0.77 ITGB3 (0.54) ITGB3ITGA2BPLGPLAUPLAT
SCHEMBL8905600 0.77 ITGB3 (0.54) ITGB3ITGA2BPLGPLAUPLAT
SCHEMBL8903868 0.76 ITGB3 (0.49) ITGB3ITGA2BPLGPLAUPLAT

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
US-5753670-A ANTICOAGULANTS THE GREEN CROSS CORPORATION (JP) 1998-05-19 US disclosed
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