SCHEMBL7306244

SCHEMBL7306244

CCOC(=O)CCN1CCn2nc(C(=O)NC[C@H](NC(=O)OCc3ccccc3)C(=O)OC(C)(C)C)cc2C1=O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 8/20 0.42
ITGA2B P08514 8/20 0.42
SYK P43405 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
BCHE P06276 2/20 0.41
ACHE P22303 2/20 0.41
CACNA1F O60840 1/20 0.41
CACNA1D Q01668 1/20 0.41
CACNA1S Q13698 1/20 0.41
CACNA1C Q13936 1/20 0.41
LMNA P02545 2/20 0.39
PKM P14618 1/20 0.37
MCHR1 Q99705 1/20 0.36

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
SCHEMBL7301488 0.96 ITGB3 (0.43) ITGB3ITGA2BSYKSMN1; SMN2BCHE
SCHEMBL6474409 0.92 ITGB3 (0.46) ITGB3ITGA2BSMN1; SMN2BCHEACHE
SCHEMBL6480916 0.88 ITGB3 (0.47) ITGB3ITGA2BSMN1; SMN2BCHEACHE
SCHEMBL7301850 0.88 ITGB3 (0.39) ITGB3ITGA2BSYKSMN1; SMN2PKM
SCHEMBL7304338 0.85 ITGB3 (0.40) ITGB3ITGA2BSYKSMN1; SMN2PKM
SCHEMBL7422874 0.82 ITGB3 (0.47) ITGB3ITGA2BSMN1; SMN2PKM
SCHEMBL6475204 0.79 PKM (0.49) ITGB3ITGA2BSMN1; SMN2LMNAPKM
SCHEMBL7678810 0.78 SMN1; SMN2 (0.44) ITGB3ITGA2BSMN1; SMN2LMNAPKM
SCHEMBL7306172 0.76 ITGB3 (0.40) ITGB3ITGA2BSMN1; SMN2PKMMCHR1
SCHEMBL6482088 0.74 SYK (0.41) ITGB3ITGA2BSYKBCHEACHE

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
EP-0854140-B1 Vitronectin receptor antagonists, their production and their use SANOFI AVENTIS DEUTSCHLAND (DE) 2013-11-06 EP disclosed
US-5622984-A INHIBITORS OF PHOSPHOLIPASE, VARIOUS PROTEASES ONO PHARMACEUTICAL COMPANY, LIMITED (JP) 1997-04-22 US disclosed
US-5614555-A Amidinophenol derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1997-03-25 US disclosed
EP-0588655-B1 Amidinophenol derivatives ONO PHARMACEUTICAL CO (JP) 1996-12-04 EP disclosed
US-5432178-A Substituted benzoic acid esters; use to prevent or treat inflammatory diseases, allergic diseases, disseminated intravascular coagulation, pancreatitis or multiple organ failure ONO PHARMACEUTICAL CO., LTD. (JP) 1995-07-11 US disclosed
EP-0588655-A1 Amidinophenol derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1994-03-23 EP disclosed