SCHEMBL6164550

SCHEMBL6164550

CC(C)(C)NS(=O)(=O)c1ccccc1-c1c(-c2ccccc2)cnc(-c2cccc(C#N)c2)c1C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 17/20 0.46
FEN1 P39748 17/20 0.46
CSNK1E P49674 2/20 0.42
CSNK1D P48730 1/20 0.42
SGK1 O00141 1/20 0.38

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
SCHEMBL6166685 0.92 CSNK1E (0.40) ALOX5APFEN1CSNK1ECSNK1DSGK1
SCHEMBL6164560 0.85 ALOX5AP (0.45) ALOX5APFEN1CSNK1ECSNK1D
SCHEMBL6164546 0.85 CSNK1E (0.43) ALOX5APFEN1CSNK1ECSNK1D
SCHEMBL6166679 0.80 CSNK1E (0.41) ALOX5APFEN1CSNK1ECSNK1D
SCHEMBL6166620 0.78 ALOX5AP (0.44) ALOX5APFEN1CSNK1E
SCHEMBL6166689 0.78 CSNK1E (0.41) ALOX5APFEN1CSNK1ECSNK1DSGK1
SCHEMBL6165046 0.77 ALOX5AP (0.42) ALOX5APFEN1CSNK1ECSNK1DSGK1
SCHEMBL6164549 0.72 F10 (0.56) ALOX5APFEN1
SCHEMBL7389491 0.71 F10 (0.45) ALOX5APFEN1
SCHEMBL6166400 0.71 ALOX5AP (0.47) ALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1254136-A4 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD (KR) 2005-06-01 EP disclosed
EP-1254136-A1 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG Chem Investment, Ltd. (KR) 2002-11-06 EP disclosed
WO-2001055146-A1 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD. (KR) 2001-08-02 WO disclosed