SCHEMBL12514664

SCHEMBL12514664

CCCCS(=O)(=O)N[C@H](CO)C(=O)NC(C)C(=O)NCc1ccc(C(=N)N)cc1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 17/20 0.48
▸ MASP2 O00187 6/20 0.48
▸ ITGB3 P05106 2/20 0.47
▸ ITGA2B P08514 2/20 0.47
▸ F7 P08709 1/20 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
SCHEMBL12514600 0.89 F7 (0.42) F2MASP2ITGB3ITGA2BF7
SCHEMBL12514663 0.86 ITGB3 (0.44) F2MASP2ITGB3ITGA2BF7
SCHEMBL12514168 0.85 ITGB3 (0.48) F2ITGB3ITGA2BF7
SCHEMBL12514672 0.79 F2 (0.54) F2MASP2
SCHEMBL12514587 0.77 PLG (0.36) F2ITGB3ITGA2B
SCHEMBL12514177 0.77 F2 (0.58) F2MASP2F7
SCHEMBL12514178 0.76 F2 (0.56) F2F7
SCHEMBL12514559 0.76 F2 (0.54) F2MASP2
SCHEMBL12514336 0.75 SIRT2 (0.42) ITGB3ITGA2B
SCHEMBL12847292 0.75 F2 (0.58) F2F7

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-1808440-B1 Non-covalent inhibitors of urokinase and blood vessel formation WILEX AG (DE) 2011-07-27 — — EP disclosed
EP-1808440-A1 Non-covalent inhibitors of urokinase and blood vessel formation Wilex AG (DE) 2007-07-18 — — EP disclosed
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