SCHEMBL5777314

SCHEMBL5777314

N#Cc1ccc2cc(C3CC3c3ccc4c(c3)C(C3CCCCC3)=NCC4)ccc2c1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLAU P00749 8/20 0.66
PLG P00747 6/20 0.66
PLAT P00750 6/20 0.66
KLK1 P06870 5/20 0.66
SLC6A4 P31645 4/20 0.43
SLC6A2 P23975 3/20 0.43
SLC6A3 Q01959 3/20 0.43
F2 P00734 1/20 0.40
KLKB1 P03952 1/20 0.40
PRSS1 P07477 1/20 0.40
AR P10275 3/20 0.33
PTH1R Q03431 2/20 0.33
KDM2B Q8NHM5 1/20 0.32
CYP19A1 P11511 1/20 0.31
BACE1 P56817 1/20 0.30

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
SCHEMBL5799891 0.89 PLAU (0.55) PLAUPLGPLATKLK1SLC6A4
SCHEMBL2796204 0.84 PLG (0.45) PLAUPLGPLATKLK1F2
SCHEMBL5775320 0.83 PLAU (0.49) PLAUPLGPLATKLK1SLC6A4
SCHEMBL5775312 0.83 PLAU (0.49) PLAUPLGPLATKLK1SLC6A4
SCHEMBL5778208 0.80 PLAU (0.65) PLAUPLGPLATKLK1SLC6A4
SCHEMBL5776089 0.80 PLAU (0.65) PLAUPLGPLATKLK1SLC6A4
SCHEMBL5774895 0.80 PLAU (0.65) PLAUPLGPLATKLK1SLC6A4
SCHEMBL5771898 0.79 PLAU (1.00) PLAUPLGPLATKLK1F2
SCHEMBL5774004 0.79 PLAU (0.66) PLAUPLGPLATKLK1SLC6A4
SCHEMBL5771966 0.78 SLC6A4 (0.47) PLAUPLGPLATKLK1SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1276722-B1 NAPHTHAMIDINE UROKINASE INHIBITORS ABBOTT LAB (US) 2006-03-08 EP disclosed
EP-1276722-A1 NAPHTHAMIDINE UROKINASE INHIBITORS Abbott Laboratories (US) 2003-01-22 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
WO-2001081314-A1 NAPHTHAMIDINE UROKINASE INHIBITORS ABBOTT LABORATORIES (US) 2001-11-01 WO disclosed