SCHEMBL4558058

SCHEMBL4558058

CC(C)c1cc(C(C)C)c(S(=O)(=O)C(C)N(c2ccc(C[C@H](N)C(=O)O)cc2NC(=N)N)N2CCNCC2)c(C(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLG P00747 17/20 0.43
PLAU P00749 17/20 0.43
F10 P00742 7/20 0.43
ST14 Q9Y5Y6 6/20 0.43
F2 P00734 5/20 0.43
HPN P05981 2/20 0.39
HGFAC Q04756 2/20 0.39

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
SCHEMBL4557533 0.89 PLG (0.48) PLGPLAUF10ST14F2
Hydrochloric Acid SCHEMBL4458403 0.88 PLG (0.47) PLGPLAUF10ST14F2
SCHEMBL2953288 0.76 PLAU (0.48) PLGPLAUF10ST14F2
Hydrochloric Acid SCHEMBL4451933 0.75 PLAU (0.48) PLGPLAUF10ST14F2
SCHEMBL2954061 0.67 PLAU (0.52) PLGPLAUF10ST14F2
Hydrochloric Acid SCHEMBL250043 0.66 PLAU (0.51) PLGPLAUF10ST14F2
SCHEMBL4619934 0.63 PLAU (0.44) PLGPLAUF10ST14F2
SCHEMBL6129266 0.62 PLAU (0.61) PLGPLAUF10ST14F2
SCHEMBL2265830 0.59 SLC7A5 (0.53)
SCHEMBL31329363 0.59 SLC7A5 (0.53)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1511721-B1 GUANIDINO PHENYLALANIN COMPOUNDS USED AS UROKINASE INHIBITORS WILEX AG (DE) 2009-07-01 EP disclosed