SCHEMBL6993419

SCHEMBL6993419

NS(=O)(=O)c1ccc2ccnc(Cl)c2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 3/20 0.60
PLG P00747 2/20 0.60
PLAT P00750 2/20 0.60
PARG Q86W56 1/20 0.57
LMNA P02545 2/20 0.44
CA9 Q16790 5/20 0.43
CA1 P00915 5/20 0.43
CA2 P00918 5/20 0.43
CA12 O43570 3/20 0.43
CA6 P23280 3/20 0.43
CA5A P35218 3/20 0.43
CA7 P43166 3/20 0.43
CA14 Q9ULX7 3/20 0.43
CA5B Q9Y2D0 3/20 0.43
CA4 P22748 2/20 0.43
VCAM1 P19320 1/20 0.42
CA3 P07451 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL17824799 0.85 PARG (0.58) PLAUPLGPLATPARGLMNA
SCHEMBL27527771 0.80 PARG (0.53) PLAUPLGPLATPARGLMNA
SCHEMBL6998566 0.75 PLG (0.65) PLAUPLGPLATPARGCA9
SCHEMBL6993186 0.73 PLAU (0.65) PLAUPLGPLATCA9CA1
SCHEMBL2595325 0.73 CA9 (0.50) PLAUPLGPLATCA9CA1
Propylene Oxide SCHEMBL11889807 0.73 PARG (0.53) PLAUPLGPLATPARGLMNA
SCHEMBL17825169 0.73 PARG (1.00) PARG
SCHEMBL25368878 0.73 MAPT (0.47) PLAUPARGLMNACYP3A4MAPT
SCHEMBL6436143 0.73 PLAU (0.59) PLAUPLGPLATPARGLMNA
SCHEMBL14058906 0.72 LMNA (0.56) PLAUPLGPLATLMNACA9

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-1023268-B1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER LTD (GB) 2003-05-21 EP disclosed
US-6248738-B1 ANTIULCER AGENTS, ANGIOGENESIS INHIBITORS, ANTIMETASTASIS AGENTS, ANTITUMOR AGENTS PFIZER INC. 2001-06-19 US disclosed
CN-1275979-A Isoquinoline compounds useful as urokinase inhibitors PFIZER (US) 2000-12-06 CN disclosed
EP-1023268-A1 ISOQUINOLINES AS UROKINASE INHIBITORS Pfizer Limited (GB) 2000-08-02 EP disclosed
WO-1999020608-A1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER LIMITED (GB) 1999-04-29 WO disclosed