SCHEMBL7303074

SCHEMBL7303074

NCc1ccc(NC(=O)c2ccc3c(c2)CC(CC(=O)O)CC3)cc1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 10/20 0.67
ITGA2B P08514 10/20 0.67
DGAT1 O75907 1/20 0.51
PLAU P00749 2/20 0.48
PLG P00747 1/20 0.46
PLAT P00750 1/20 0.46
KLKB1 P03952 1/20 0.46
PRSS1 P07477 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
MCHR1 Q99705 4/20 0.46

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
SCHEMBL7310729 0.94 ITGB3 (0.77) ITGB3ITGA2BDGAT1MCHR1
SCHEMBL7298855 0.87 ITGB3 (0.88) ITGB3ITGA2BDGAT1PLAU
SCHEMBL7306072 0.87 ITGB3 (0.77) ITGB3ITGA2BDGAT1MCHR1
SCHEMBL7305638 0.82 ITGB3 (0.55) ITGB3ITGA2BDGAT1MCHR1
SCHEMBL7300021 0.82 ITGB3 (0.86) ITGB3ITGA2BDGAT1MCHR1
SCHEMBL7298489 0.80 ITGB3 (1.00) ITGB3ITGA2BPLAUMCHR1
SCHEMBL7298689 0.80 ITGB3 (0.58) ITGB3ITGA2BMCHR1
SCHEMBL7396140 0.80 ITGB3 (0.74) ITGB3ITGA2BDGAT1MCHR1
Hydrochloric Acid SCHEMBL7309818 0.80 ITGB3 (0.98) ITGB3ITGA2BPLAUMCHR1
SCHEMBL7444354 0.79 ITGB3 (0.73) ITGB3ITGA2BDGAT1MCHR1

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