SCHEMBL1629341

SCHEMBL1629341

COc1cccc(S(=O)(=O)N(CC(=O)O)c2ccc(Cl)cc2)c1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 12/20 0.66
NFE2L2 Q16236 12/20 0.66
PGR P06401 1/20 0.57
OXTR P30559 1/20 0.55
AVPR1A P37288 1/20 0.55
MAPT P10636 2/20 0.54
TP53 P04637 1/20 0.54

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
SCHEMBL1629270 0.89 NR1I2 (0.57) KEAP1NFE2L2PGROXTRAVPR1A
SCHEMBL1630949 0.85 KEAP1 (0.87) KEAP1NFE2L2MAPTTP53
SCHEMBL1630148 0.85 HCRTR2 (0.61) KEAP1NFE2L2PGROXTRAVPR1A
SCHEMBL1632612 0.84 HCRTR2 (0.61) KEAP1NFE2L2OXTR
SCHEMBL1629149 0.81 HCRTR2 (0.58) KEAP1NFE2L2OXTR
SCHEMBL27910116 0.81 BMP1 (0.58) KEAP1NFE2L2PGROXTRAVPR1A
SCHEMBL1629905 0.79 KEAP1 (0.76) KEAP1NFE2L2
SCHEMBL1630305 0.79 KEAP1 (0.71) KEAP1NFE2L2PGROXTRMAPT
SCHEMBL1629157 0.79 KEAP1 (0.70) KEAP1NFE2L2
SCHEMBL1629052 0.78 HTT (0.49) KEAP1NFE2L2PGROXTRAVPR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2245006-B1 SULFONAMIDES AS OREXIN ANTAGONISTS HOFFMANN LA ROCHE (CH) 2011-06-01 EP disclosed
EP-2245006-B1 SULFONAMIDES AS OREXIN ANTAGONISTS HOFFMANN LA ROCHE (CH) 2011-06-01 EP disclosed
US-7932269-B2 Sulfonamides as orexin antagonists HOFFMANN-LA ROCHE INC. (US) 2011-04-26 US disclosed
US-7932269-B2 Sulfonamides as orexin antagonists HOFFMANN-LA ROCHE INC. (US) 2011-04-26 US disclosed
US-7932269-B2 Sulfonamides as orexin antagonists HOFFMANN-LA ROCHE INC. (US) 2011-04-26 US disclosed
EP-2245006-A1 SULFONAMIDES AS OREXIN ANTAGONISTS F. Hoffmann-La Roche AG (CH) 2010-11-03 EP disclosed
WO-2009092642-A1 SULFONAMIDES AS OREXIN ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-07-30 WO disclosed
WO-2009092642-A1 SULFONAMIDES AS OREXIN ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-07-30 WO disclosed
US-20090186920-A1 SULFONAMIDES AS OREXIN ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-07-23 US disclosed
US-20090186920-A1 SULFONAMIDES AS OREXIN ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-07-23 US disclosed
US-20090186920-A1 SULFONAMIDES AS OREXIN ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-07-23 US 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-20090186920-A1 SULFONAMIDES AS OREXIN ANTAGONISTS HCRTR2, HCRTR1, NPSR1 KEAP1 1802/4885NFE2L2 1690/4885PGR 2043/4885

“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.