SCHEMBL2786763

SCHEMBL2786763

O=C(O)C[C@@H](c1ccc2c(c1)OCC2)N1CCCN(CCCc2ccc3c(n2)NCCC3)C1=O

nearest known ligand 0.93

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ITGAV P06756 20/20 0.93
▸ ITGB3 P05106 18/20 0.93
▸ ITGB6 P18564 6/20 0.66
▸ ITGB8 P26012 4/20 0.66
▸ ITGA2B P08514 4/20 0.64
▸ ITGB1 P05556 2/20 0.64
▸ ITGA5 P08648 1/20 0.64
▸ ITGB5 P18084 1/20 0.49

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
SCHEMBL6360770 0.96 ITGAV (1.00) ITGAVITGB3ITGB6ITGB8ITGA2B
SCHEMBL6432237 0.96 ITGAV (1.00) ITGAVITGB3ITGB6ITGB8ITGA2B
SCHEMBL6433051 0.96 ITGAV (1.00) ITGAVITGB3ITGB6ITGB8ITGA2B
SCHEMBL343164 0.90 ITGAV (0.76) ITGAVITGB3ITGB6ITGB8ITGA2B
SCHEMBL6431919 0.87 ITGAV (0.82) ITGAVITGB3ITGB6ITGB8ITGA2B
SCHEMBL6431924 0.87 ITGAV (0.82) ITGAVITGB3ITGB6ITGB8ITGA2B
SCHEMBL6434481 0.86 ITGAV (0.82) ITGAVITGB3ITGB6ITGB8ITGA2B
SCHEMBL6432359 0.86 ITGAV (0.82) ITGAVITGB3ITGB6ITGB8ITGA2B
SCHEMBL6432362 0.86 ITGAV (0.82) ITGAVITGB3ITGB6ITGB8ITGA2B
SCHEMBL6437606 0.86 ITGAV (0.81) ITGAVITGB3ITGB6ITGB8ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1044001-B1 INTEGRIN RECEPTOR ANTAGONISTS MERCK & CO INC (US) 2005-07-06 — — EP claimed
US-6211191-B1 TETRAHYDROPYRIMIDIN-2-ONE DERIVATIVES; BONE DISORDERS, OSTEOPOROSIS, RESTENOSIS, VISION DEFECTS; ANGIOGENESIS INHIBITORS; ANTITUMOR, ANTIARTHRITIC, ANTICARCINOGENIC, AND ANTIINFLAMMATORY AGENTS MERCK & CO., INC. 2001-04-03 — — US claimed
EP-2155769-B1 TISSUE DEGENERATION PROTECTION UNIV LEUVEN KATH (BE) 2012-06-27 — — EP disclosed
EP-2398472-A2 METHODS AND PREPARATIONS FOR PROTECTING CRITICALLY ILL PATIENTS WITH A POLYAMINE (E.G. SPERMINE, SPERMIDINE) Katholieke Universiteit Leuven, K.U. Leuven R&D (BE) 2011-12-28 — — EP disclosed
WO-2010081862-A2 METHODS AND PREPARATIONS FOR PROTECTING CRITICALLY ILL PATIENTS KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) 2010-07-22 — — WO disclosed
US-20080249016-A1 Use of GLP-2 in a combination treatment for bone-related disorders SANOS BIOSCIENCE A/S 2008-10-09 — — US disclosed
US-20070135345-A1 Use of GLP-2 for the treatment or prevention, of bone-related disorders SANOS BIOSCIENCE A/S (DK) 2007-06-14 — — US disclosed
US-7186683-B2 Use of GLP for the treatment, prevention, diagnosis, and prognosis of bone-related and nutrition-related disorders SANOS BIOSCIENCE A/S (DK) 2007-03-06 — — US disclosed
US-20050282749-A1 Use of GLP-2 and related compounds for the treatment, prevention, diagnosis, and prognosis of bone-related disorders and calcium homeostasis related syndromes SANOS BIOSCIENCE A/S 2005-12-22 — — US disclosed
EP-1044001-B1 INTEGRIN RECEPTOR ANTAGONISTS MERCK & CO INC (US) 2005-07-06 — — EP disclosed
US-20040052862-A1 Use of GLP for the treatment, prevention, diagnosis, and prognosis of bone-related and nutrition-related disorders SANOS BIOSCIENCE A/S (DE) 2004-03-18 — — US disclosed
US-20020037836-A1 Use of GLP for the treatment, prevention, diagnosis, and prognosis of bone-related and nutrition-related disorders SANOS BIOSCIENCE A/S (DK) 2002-03-28 — — US disclosed
US-6211191-B1 TETRAHYDROPYRIMIDIN-2-ONE DERIVATIVES; BONE DISORDERS, OSTEOPOROSIS, RESTENOSIS, VISION DEFECTS; ANGIOGENESIS INHIBITORS; ANTITUMOR, ANTIARTHRITIC, ANTICARCINOGENIC, AND ANTIINFLAMMATORY AGENTS MERCK & CO., INC. 2001-04-03 — — US disclosed
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