SCHEMBL6163597

SCHEMBL6163597

COC(=O)c1ccc(-c2ccccc2S(=O)(=O)NC(C)(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.53
ALOX5AP P20292 11/20 0.52
FEN1 P39748 11/20 0.52
CDC25B P30305 2/20 0.49
PTPRC P08575 1/20 0.49
PTPRF P10586 1/20 0.49
PTPN1 P18031 1/20 0.49
EGFR P00533 1/20 0.48
PTGS2 P35354 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
CDC25A P30304 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL7266386 0.86 ALOX5AP (0.54) GPR119ALOX5APFEN1
SCHEMBL890690 0.86 ALOX5AP (0.54) GPR119ALOX5APFEN1
SCHEMBL890655 0.84 ALOX5AP (0.53) GPR119ALOX5APFEN1
SCHEMBL7128878 0.83 ALOX5AP (0.53) ALOX5APFEN1
SCHEMBL6166229 0.83 HPGD (0.48) EGFRPTGS2ALDH1A1CA12CA1
SCHEMBL6167248 0.82 PTGS1 (0.47) ALOX5APFEN1EGFRPTGS2ALDH1A1
SCHEMBL1968159 0.80 ALOX5AP (0.59) ALOX5APFEN1
SCHEMBL890614 0.79 F10 (0.51) GPR119ALOX5APFEN1ALDH1A1
SCHEMBL6628076 0.79 ALOX5AP (0.59) ALOX5APFEN1ALDH1A1
SCHEMBL8001453 0.79 ALOX5AP (0.51) GPR119ALOX5APFEN1

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 GPR119 3790/4885ALOX5AP 680/4885FEN1 2108/4885

“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.