SCHEMBL5776714

SCHEMBL5776714

CCCC1c2cc(C3CC3c3ccc4cc(C#N)ccc4c3)ccc2CCN1C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLAU P00749 4/20 0.46
SLC6A4 P31645 3/20 0.44
SLC6A3 Q01959 3/20 0.44
PLG P00747 2/20 0.44
PLAT P00750 2/20 0.44
KLK1 P06870 2/20 0.44
SLC6A2 P23975 2/20 0.44
DRD2 P14416 3/20 0.40
DRD3 P35462 3/20 0.40
KMT2A Q03164 1/20 0.36
KDM2B Q8NHM5 2/20 0.35
ASIC3 Q9UHC3 1/20 0.35
KCNN2 Q9H2S1 2/20 0.34
KCNN3 Q9UGI6 2/20 0.34
KCNN1 Q92952 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
SCHEMBL5774652 0.84 PLAU (0.64) PLAUSLC6A4SLC6A3PLGPLAT
SCHEMBL5776360 0.81 PLAU (0.66) PLAUSLC6A4SLC6A3PLGPLAT
SCHEMBL5777466 0.80 PLAU (0.73) PLAUPLGPLATKLK1ASIC3
SCHEMBL5776998 0.77 PLAU (0.50) PLAUSLC6A4SLC6A3PLGPLAT
SCHEMBL5777688 0.75 PLAU (0.52) PLAUSLC6A4SLC6A3PLGPLAT
SCHEMBL5779436 0.74 PLAU (0.52) PLAUSLC6A4SLC6A3PLGPLAT
SCHEMBL5777574 0.73 SLC6A4 (0.46) PLAUSLC6A4SLC6A3PLGPLAT
SCHEMBL5778721 0.73 SLC6A2 (0.47) PLAUSLC6A4SLC6A3PLGPLAT
SCHEMBL5778140 0.73 PLAU (0.50) PLAUSLC6A4SLC6A3PLGPLAT
SCHEMBL5777909 0.72 PLAU (0.47) PLAUSLC6A4SLC6A3PLGPLAT

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