SCHEMBL2261153

SCHEMBL2261153

COc1ccc(S(=O)(=O)Nc2cc(N(C)C)ccc2Cl)cc1OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
TP53 P04637 1/20 0.61
KEAP1 Q14145 1/20 0.55
NFE2L2 Q16236 1/20 0.55
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
MAPK1 P28482 2/20 0.54
LMNA P02545 5/20 0.53
HTT P42858 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
PKM P14618 2/20 0.53
TSHR P16473 2/20 0.53
NPSR1 Q6W5P4 1/20 0.53
GAA P10253 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C19 P33261 1/20 0.52
HCRTR1 O43613 1/20 0.52
HCRTR2 O43614 1/20 0.52

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
SCHEMBL2259210 0.85 ALDH1A1 (0.57) ALDH1A1TP53KEAP1NFE2L2KMT2A
SCHEMBL2260667 0.82 ALDH1A1 (0.54) ALDH1A1TP53KEAP1NFE2L2KMT2A
SCHEMBL2263708 0.80 ALDH1A1 (0.61) ALDH1A1TP53KEAP1NFE2L2KMT2A
SCHEMBL2261171 0.79 ALDH1A1 (0.60) ALDH1A1TP53KEAP1NFE2L2KMT2A
SCHEMBL2260544 0.79 ALDH1A1 (0.62) ALDH1A1TP53KEAP1NFE2L2KMT2A
SCHEMBL2260761 0.78 ALDH1A1 (0.58) ALDH1A1TP53KEAP1NFE2L2KMT2A
SCHEMBL2261232 0.78 ALDH1A1 (0.58) ALDH1A1TP53KEAP1NFE2L2KMT2A
SCHEMBL27766045 0.78 ALDH1A1 (0.58) ALDH1A1TP53KEAP1NFE2L2KMT2A
SCHEMBL4664207 0.75 ALDH1A1 (0.55) ALDH1A1TP53KEAP1NFE2L2KMT2A
SCHEMBL7591017 0.73 KEAP1 (0.67) ALDH1A1TP53KEAP1NFE2L2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101460453-B Novel sulfonamide compounds ACTELION PHARMACEUTICALS LTD 2012-10-03 CN disclosed
US-8003654-B2 N-glycinsulfonamide derivatives and uses as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2011-08-23 US disclosed
US-20090275588-A1 NOVEL SULFONAMIDE COMPOUNDS ACTELION PHARMACEUTICALS LTD. (CH) 2009-11-05 US disclosed
CN-101460453-A Novel sulfonamide compounds ACTELION PHARMACEUTICALS LTD (CH) 2009-06-17 CN disclosed
EP-2007717-A1 NOVEL SULFONAMIDE COMPOUNDS Actelion Pharmaceuticals Ltd. (CH) 2008-12-31 EP disclosed
WO-2007116374-A1 NOVEL SULFONAMIDE COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2007-10-18 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-20090275588-A1 NOVEL SULFONAMIDE COMPOUNDS HCRTR2, HCRTR1, NPSR1 ALDH1A1 2824/4885TP53 4868/4885KEAP1 1432/4885

“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.