SCHEMBL7309996

SCHEMBL7309996

NCCCC1C(=O)N(CC(=O)O)CCN1C(=O)CN

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.50
ITGA2B P08514 20/20 0.50

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
SCHEMBL7295388 1.00 ITGB3 (0.50) ITGB3ITGA2B
SCHEMBL7284654 0.85 ITGB3 (0.60) ITGB3ITGA2B
SCHEMBL7315345 0.76 ITGB3 (0.55) ITGB3ITGA2B
SCHEMBL7315330 0.76 ITGB3 (0.55) ITGB3ITGA2B
SCHEMBL7315322 0.73 ITGB3 (0.42) ITGB3ITGA2B
SCHEMBL7295382 0.71 ITGB3 (0.38) ITGB3ITGA2B
Hydrochloric Acid SCHEMBL7277701 0.68 ITGB3 (0.47) ITGB3ITGA2B
SCHEMBL8221099 0.68 ITGB3 (0.48) ITGB3ITGA2B
SCHEMBL7278333 0.67 ITGB3 (0.43) ITGB3ITGA2B
SCHEMBL7276069 0.65 ITGB3 (0.47) ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0950658-A1 2-Pipirazinone-1-acetic acid dihydrochloride derivative used to inhibit platelet aggregation Takeda Chemical Industries, Ltd. (JP) 1999-10-20 EP claimed
EP-0950407-B1 The use of a GP IIb/IIIa antagonist for the manufacture of a medicament suitable for transdermal application by iontophoresis HISAMITSU PHARMACEUTICAL CO (JP) 2002-09-04 EP disclosed
US-6322550-B2 Method for transdermal administration of GP IIb/IIIa antagonist HISAMITSU PHARMACEUTICAL CO., INC. (JP) 2001-11-27 US disclosed
US-20010018568-A1 METHOD FOR TRANSDERMAL ADMINISTRATION OF GP IIB/IIIA ANTAGONIST HISAMITSU PHARMACEUTICAL CO., INC. (JP) 2001-08-30 US disclosed
JP-2000001480-A 2-PIPERAZINONE-1-ACETIC ACID DERIVATIVE, ITS PRODUCTION AND USE TAKEDA CHEM IND LTD 2000-01-07 JP disclosed
EP-0950658-A1 2-Pipirazinone-1-acetic acid dihydrochloride derivative used to inhibit platelet aggregation Takeda Chemical Industries, Ltd. (JP) 1999-10-20 EP disclosed
EP-0950407-A1 Method for transdermal administration of GP IIb/IIIa antagonist Takeda Chemical Industries, Ltd. (JP) 1999-10-20 EP disclosed
EP-0822931-A1 PIPERAZINONES USEFUL AS INHIBITORS OF PLATELET AGGREGATION Takeda Chemical Industries, Ltd. (JP) 1998-02-11 EP disclosed
WO-1996033982-A1 PIPERAZINONES USEFUL AS INHIBITORS OF PLATELET AGGREGATION TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-10-31 WO disclosed