SCHEMBL7294189

SCHEMBL7294189

N=C(N)NCCCCNCCC[C@H]1C(=O)N(CC(=O)O)CCN1C(=O)CNC(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 19/20 0.53
ITGA2B P08514 19/20 0.53

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
SCHEMBL8214593 0.92 ITGB3 (0.51) ITGB3ITGA2B
SCHEMBL8553717 0.90 ITGB3 (0.51) ITGB3ITGA2B
SCHEMBL7295048 0.88 ITGB3 (0.69) ITGB3ITGA2B
SCHEMBL7334492 0.88 ITGB3 (0.69) ITGB3ITGA2B
SCHEMBL7315330 0.86 ITGB3 (0.55) ITGB3ITGA2B
SCHEMBL7315345 0.86 ITGB3 (0.55) ITGB3ITGA2B
SCHEMBL7311516 0.84 ITGB3 (0.46) ITGB3ITGA2B
SCHEMBL8355283 0.84 PREP (0.43) ITGB3ITGA2B
SCHEMBL7286648 0.81 ITGB3 (0.43) ITGB3ITGA2B
SCHEMBL7284719 0.80 ITGB3 (0.43) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0822931-B1 PIPERAZINONES USEFUL AS INHIBITORS OF PLATELET AGGREGATION TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2002-03-27 EP disclosed
EP-0822931-A1 PIPERAZINONES USEFUL AS INHIBITORS OF PLATELET AGGREGATION Takeda Chemical Industries, Ltd. (JP) 1998-02-11 EP disclosed
EP-0765660-A2 Microcapsules comprising 2-piperazinone-1-acetic acid compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-04-02 EP disclosed
WO-1996033982-A1 PIPERAZINONES USEFUL AS INHIBITORS OF PLATELET AGGREGATION TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-10-31 WO disclosed