SCHEMBL6165516

SCHEMBL6165516

CC(C)(C)NS(=O)(=O)c1ccccc1-c1ccc(-c2cccc(C(N)=O)c2-c2ccc(C#N)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 13/20 0.44
FEN1 P39748 13/20 0.44
USP30 Q70CQ3 2/20 0.41
PARP1 P09874 3/20 0.40
PARP2 Q9UGN5 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.40

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
SCHEMBL7104689 0.96 ALOX5AP (0.42) ALOX5APFEN1USP30PARP1PARP2
SCHEMBL6166620 0.91 ALOX5AP (0.44) ALOX5APFEN1
SCHEMBL6167425 0.85 F10 (0.43) PARP1PARP2IRAK4
SCHEMBL6165511 0.80 F10 (0.46) ALOX5APFEN1
SCHEMBL7104688 0.78 F10 (0.54) ALOX5APFEN1
SCHEMBL6166616 0.74 F10 (0.52) ALOX5APFEN1
SCHEMBL6164560 0.73 ALOX5AP (0.45) ALOX5APFEN1
SCHEMBL28045856 0.72 BCAT2 (0.65) PARP1PARP2IRAK4
SCHEMBL15936747 0.72 ALOX5AP (0.62) ALOX5APFEN1
SCHEMBL6164550 0.71 ALOX5AP (0.46) 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 4 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
US-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof LG CHEM INVESTMENT LTD. (KR) 2003-04-03 US 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof F2, F12, TFPI ALOX5AP 680/4885FEN1 2108/4885USP30 4394/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.