SCHEMBL7274869

SCHEMBL7274869

Cc1cc(CCC(=O)O)ccc1N1CCN(c2ccc(C(=N)N)cc2)C1=O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 17/20 0.57
ITGA2B P08514 17/20 0.57
F10 P00742 2/20 0.45
F2 P00734 1/20 0.45
PRSS1 P07477 1/20 0.45
S1PR1 P21453 1/20 0.41

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
SCHEMBL7274574 0.94 ITGB3 (0.57) ITGB3ITGA2BF10F2PRSS1
Hydrochloric Acid SCHEMBL7281783 0.88 F10 (0.43) ITGB3ITGA2BF10F2PRSS1
SCHEMBL7283193 0.88 ITGB3 (0.57) ITGB3ITGA2BF10F2PRSS1
SCHEMBL7281126 0.88 ITGB3 (0.57) ITGB3ITGA2BF10F2PRSS1
SCHEMBL7283253 0.87 ITGB3 (0.54) ITGB3ITGA2BF10F2PRSS1
SCHEMBL7281086 0.87 ITGB3 (0.54) ITGB3ITGA2BF10F2PRSS1
SCHEMBL7274080 0.87 ITGB3 (0.74) ITGB3ITGA2BF10F2PRSS1
SCHEMBL7273134 0.86 ITGB3 (0.53) ITGB3ITGA2BF10F2PRSS1
SCHEMBL7273410 0.85 ITGB3 (0.52) ITGB3ITGA2BF10F2PRSS1
SCHEMBL7282936 0.85 S1PR1 (0.46) ITGB3ITGA2BS1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5852192-A Cyclic urea derivatives, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1998-12-22 US disclosed
US-5650424-A ANTIAGGLOMERANTS USING IMIDAZOLIDINDIONES DR. KARL THOMAE GMBH (DE) 1997-07-22 US disclosed
EP-0503548-B1 Cyclic urea derivatives, medicaments contaning them and process for their preparation THOMAE GMBH DR K (DE) 1997-06-04 EP disclosed
US-5478942-A Antiinflammatory agents, antiagglomerants KARL THOMAE GMBH (DE) 1995-12-26 US disclosed
US-5276049-A Treatment of thrombosis DR. KARL THOMAE GMBH (DE) 1994-01-04 US disclosed
EP-0503548-A1 Cyclic urea derivatives, medicaments contaning them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-09-16 EP disclosed