SCHEMBL6086941

SCHEMBL6086941

C=CCCN(c1ccc(OC)cc1)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
ALDH1A1 P00352 5/20 0.41
HPGD P15428 1/20 0.41
CYP3A4 P08684 3/20 0.40
TSHR P16473 3/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
LMNA P02545 3/20 0.39
POLB P06746 2/20 0.38
HTT P42858 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA13 Q8N1Q1 1/20 0.38
APLNR P35414 1/20 0.38
NR3C1 P04150 1/20 0.38
PGR P06401 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
SCHEMBL6086451 0.93 BMP1 (0.40) KEAP1NFE2L2ALDH1A1HPGDCYP3A4
SCHEMBL6087539 0.87 RAB9A (0.45) KEAP1NFE2L2ALDH1A1HPGDCYP3A4
SCHEMBL6088452 0.80 KEAP1 (0.47) KEAP1NFE2L2ALDH1A1CYP3A4TSHR
SCHEMBL6086093 0.79 KEAP1 (0.46) KEAP1NFE2L2ALDH1A1CYP3A4TSHR
SCHEMBL6087706 0.77 KEAP1 (0.41) KEAP1NFE2L2ALDH1A1CYP3A4TSHR
SCHEMBL6087264 0.75 BMP1 (0.40) KEAP1NFE2L2ALDH1A1CYP3A4TSHR
SCHEMBL14108741 0.74 KEAP1 (0.50) KEAP1NFE2L2ALDH1A1HPGDTSHR
SCHEMBL6086898 0.73 HTT (0.48) KEAP1NFE2L2ALDH1A1CYP3A4TSHR
SCHEMBL29671340 0.68 APLNR (0.61) CA12CA1CA2CA7CA9
SCHEMBL1359540 0.67 BCL2A1 (0.61) ALDH1A1HPGDCYP3A4TSHRLMNA

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0939627-B1 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK INC (US) 2003-09-10 EP claimed
US-20030162817-A1 Pentafluorobenzenesulfonamides and analogs TULARIK INC. 2003-08-28 US claimed
JP-3421350-B2 2003-06-30 JP claimed
US-6482860-B1 such as batabulin (2-Fluoro-1-methoxy-4-pentafluorophenylsulfonamidobenzene), use as antiproliferative agents to treat cancer TULARIK INC. 2002-11-19 US claimed
US-20020143036-A1 Pentafluorobenzenesulfonamides and analogs TULARIK INC. 2002-10-03 US claimed
JP-2000515545-A 2000-11-21 JP claimed
EP-0939627-A4 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK INC (US) 2000-10-04 EP claimed
EP-0939627-A1 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1999-09-08 EP claimed
EP-0896533-A4 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK INC (US) 1999-04-28 EP claimed
US-5880151-A TREATING OR PREVENTING DISEASE CHARACTERIZED BY HIGH LEVELS OF LOW DENSITY LIPOPROTEIN PARTICLES OR CHOLESTEROL IN BLOOD TULARIK INC. (US) 1999-03-09 US claimed
EP-0896533-A2 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1999-02-17 EP claimed
WO-1998005315-A1 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1998-02-12 WO claimed
WO-1997030677-A2 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1997-08-28 WO claimed
US-7138418-B2 For therapy of atherosclerosis and hypercholesterolemia; 5-Pentafluorophenylsulfonamidoindazole for example; increasing LDL receptor gene expression in a cell AMGEN, INC. (US) 2006-11-21 US disclosed
US-6962929-B2 Pentafluorobenzenesulfonamides and analogs TULARIK INC. (US) 2005-11-08 US disclosed
EP-0896533-B1 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK INC (US) 2003-09-10 EP disclosed
US-5880151-A TREATING OR PREVENTING DISEASE CHARACTERIZED BY HIGH LEVELS OF LOW DENSITY LIPOPROTEIN PARTICLES OR CHOLESTEROL IN BLOOD TULARIK INC. (US) 1999-03-09 US disclosed
EP-0896533-A2 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1999-02-17 EP disclosed
WO-1998005315-A1 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1998-02-12 WO disclosed
WO-1997030677-A2 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1997-08-28 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 (2 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-20030162817-A1 Pentafluorobenzenesulfonamides and analogs FGFR1, FPR1, FGF1 KEAP1 1968/4885NFE2L2 1844/4885ALDH1A1 1192/4885
US-20020143036-A1 Pentafluorobenzenesulfonamides and analogs FFAR1, PCSK9, PFAS KEAP1 809/4885NFE2L2 1795/4885ALDH1A1 1403/4885

“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.