SCHEMBL5774505

SCHEMBL5774505

C=CCN1CCc2ccc(C3CC3c3ccc4cc(C(=N)N)ccc4c3)cc2C1C(C)C

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLAU P00749 16/20 0.72
PLG P00747 11/20 0.72
PLAT P00750 10/20 0.72
KLK1 P06870 9/20 0.72
ASIC3 Q9UHC3 1/20 0.51
F2 P00734 2/20 0.38
KLKB1 P03952 2/20 0.38
PRSS1 P07477 2/20 0.38
PRCP P42785 1/20 0.34

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
SCHEMBL5776204 0.89 PLAU (0.77) PLAUPLGPLATKLK1ASIC3
SCHEMBL5772727 0.87 PLAU (0.78) PLAUPLGPLATKLK1ASIC3
SCHEMBL5775596 0.86 PLAU (0.76) PLAUPLGPLATKLK1ASIC3
SCHEMBL5777994 0.86 PLAU (0.72) PLAUPLGPLATKLK1ASIC3
SCHEMBL5776977 0.85 PLAU (0.71) PLAUPLGPLATKLK1ASIC3
SCHEMBL5775814 0.84 PLAU (1.00) PLAUPLGPLATKLK1ASIC3
SCHEMBL29531162 0.84 PLAU (1.00) PLAUPLGPLATKLK1ASIC3
SCHEMBL5777009 0.83 PLAU (0.80) PLAUPLGPLATKLK1ASIC3
SCHEMBL5775015 0.82 PLAU (0.47) PLAUPLGPLATKLK1ASIC3
SCHEMBL5778723 0.81 PLAU (0.65) PLAUPLGPLATKLK1ASIC3

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-1276722-A1 NAPHTHAMIDINE UROKINASE INHIBITORS Abbott Laboratories (US) 2003-01-22 EP claimed
US-6495562-B1 SUCH AS 6-(2-(4,4-DIETHYL-1-ISOPROPYL-3,4-DIHYDRO-6-ISOQUINOLINYL)CYCLOPROPYL)-2 -NAPHTHALENECARBOXIMIDAMIDE ABBOTT LABORATORIES 2002-12-17 US claimed
WO-2001081314-A1 NAPHTHAMIDINE UROKINASE INHIBITORS ABBOTT LABORATORIES (US) 2001-11-01 WO claimed
EP-1276722-B1 NAPHTHAMIDINE UROKINASE INHIBITORS ABBOTT LAB (US) 2006-03-08 EP disclosed
US-6504031-B1 Enzyme inhibitor such as 6-(2-(1-isopropyl-1,2,3,4-tetrahydro -7-isoquinolinyl)ethenyl)-2-naphthalenecarboximidamide, used as angiogenesis inhibitors; antiarthritic, antiinflammatory and antitumor agents ABBOTT LABORATORIES 2003-01-07 US disclosed
US-6495562-B1 SUCH AS 6-(2-(4,4-DIETHYL-1-ISOPROPYL-3,4-DIHYDRO-6-ISOQUINOLINYL)CYCLOPROPYL)-2 -NAPHTHALENECARBOXIMIDAMIDE ABBOTT LABORATORIES 2002-12-17 US disclosed