SCHEMBL6016567

SCHEMBL6016567

CC(C)(C)OC(=O)[C@H](Cn1cnc2c(N3CCC(c4ccc5c(n4)NCCC5)CC3)ncnc21)NC(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ITGAV P06756 20/20 0.44
ITGB3 P05106 17/20 0.44
ITGB6 P18564 4/20 0.40
ITGB5 P18084 2/20 0.40
ITGB1 P05556 1/20 0.40
ITGA5 P08648 1/20 0.40
ITGB8 P26012 1/20 0.40
ITGA2B P08514 1/20 0.38

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
SCHEMBL6016358 0.92 ITGB3 (0.50) ITGAVITGB3ITGB6ITGB5ITGB1
SCHEMBL6016500 0.87 ITGAV (0.51) ITGAVITGB3ITGB6ITGB5ITGB1
SCHEMBL6016495 0.86 ITGAV (0.40) ITGAVITGB3ITGB6ITGB5ITGB1
SCHEMBL2954954 0.85 ITGAV (0.51) ITGAVITGB3ITGB6ITGB5ITGB1
SCHEMBL2954956 0.85 ITGAV (0.51) ITGAVITGB3ITGB6ITGB5ITGB1
SCHEMBL2946838 0.85 ITGAV (0.46) ITGAVITGB3ITGB6ITGB5ITGB1
SCHEMBL13709241 0.85 ITGAV (0.46) ITGAVITGB3ITGB6ITGB5ITGB1
SCHEMBL275041 0.85 ITGAV (0.46) ITGAVITGB3ITGB6ITGB5ITGB1
SCHEMBL2949030 0.85 ITGAV (0.46) ITGAVITGB3ITGB6ITGB5ITGB1
SCHEMBL2957399 0.85 ITGAV (0.46) ITGAVITGB3ITGB6ITGB5ITGB1

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-1210348-B9 NAPHTHYRIDINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM AVENTIS PHARMA GMBH (DE) 2006-04-26 EP disclosed
EP-1210348-B1 NAPHTHYRIDINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM AVENTIS PHARMA GMBH (DE) 2005-09-28 EP disclosed
US-6743800-B1 VITRONECTIN RECEPTOR ANTAGONISTS AND INHIBITORS OF CELL ADHESION; OSTEOPOROSIS, ANGIOGENESIS INHIBITORS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-06-01 US disclosed
EP-1210348-A1 NAPHTHYRIDINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Aventis Pharma Deutschland GmbH (DE) 2002-06-05 EP disclosed
WO-2001002398-A1 NAPHTHYRIDINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-01-11 WO disclosed
EP-1065207-A1 Naphthyridine derivatives, processes for their preparation, their use, and pharmaceutical compositions comprising them Aventis Pharma Deutschland GmbH (DE) 2001-01-03 EP disclosed