SCHEMBL6989337

SCHEMBL6989337

CCCCOC(=O)OC(=O)C(N)CNC(=O)C[C@H]1C[C@@H](c2ccc(C(=N)N)cc2)NO1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 20/20 0.45
▸ ITGA2B P08514 20/20 0.45

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
SCHEMBL7844777 1.00 ITGB3 (0.45) ITGB3ITGA2B
Hydrochloric Acid SCHEMBL9093588 0.99 ITGB3 (0.46) ITGB3ITGA2B
SCHEMBL6992922 0.97 ITGB3 (0.43) ITGB3ITGA2B
SCHEMBL7378707 0.91 ITGB3 (0.37) ITGB3ITGA2B
SCHEMBL7374519 0.89 ITGB3 (0.39) ITGB3ITGA2B
SCHEMBL7375675 0.88 ITGB3 (0.43) ITGB3ITGA2B
SCHEMBL7377212 0.85 ITGB3 (0.45) ITGB3ITGA2B
SCHEMBL7374342 0.83 ITGB3 (0.66) ITGB3ITGA2B
SCHEMBL7370697 0.83 ITGB3 (0.66) ITGB3ITGA2B
SCHEMBL7845493 0.83 ITGB3 (0.66) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832076-B1 NOVEL ISOXAZOLINE AND ISOXAZOLE FIBRINOGEN RECEPTOR ANTAGONISTS BRISTOL MYERS SQUIBB PHARMA CO (US) 2003-07-16 — — EP disclosed
EP-0832076-A1 NOVEL ISOXAZOLINE AND ISOXAZOLE FIBRINOGEN RECEPTOR ANTAGONISTS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1998-04-01 — — EP disclosed
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