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Sugi Predict / Compounds / SCHEMBL7364263

SCHEMBL7364263

SCHEMBL7364263

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

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 16/20 0.49
▸ ITGA2B P08514 16/20 0.49
▸ PREP P48147 2/20 0.46
▸ SIGMAR1 Q99720 1/20 0.44

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
SCHEMBL7295450 0.94 PREP (0.45) ITGB3ITGA2BPREPSIGMAR1
SCHEMBL7311516 0.90 ITGB3 (0.46) ITGB3ITGA2BPREPSIGMAR1
SCHEMBL7287855 0.86 ITGB3 (0.52) ITGB3ITGA2BPREP
SCHEMBL8619569 0.86 SIGMAR1 (0.44) ITGB3ITGA2BPREPSIGMAR1
SCHEMBL7285021 0.86 SIGMAR1 (0.44) ITGB3ITGA2BPREPSIGMAR1
SCHEMBL7286648 0.85 ITGB3 (0.43) ITGB3ITGA2BPREPSIGMAR1
SCHEMBL7284719 0.84 ITGB3 (0.43) ITGB3ITGA2BPREPSIGMAR1
SCHEMBL7276265 0.84 ITGB3 (0.49) ITGB3ITGA2BPREPSIGMAR1
SCHEMBL7296887 0.84 PREP (0.43) ITGB3ITGA2BPREPSIGMAR1
SCHEMBL7286805 0.84 PREP (0.43) ITGB3ITGA2BPREPSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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