SCHEMBL6364323

SCHEMBL6364323

CN(C)c1ccc(NS(=O)(=O)c2cccs2)c([N+](=O)[O-])c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ALDH1A1 P00352 3/20 0.46
HTT P42858 1/20 0.46
ALDH3A1 P30838 1/20 0.45
CCR2 P41597 4/20 0.44
NPC1 O15118 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TP53 P04637 1/20 0.43
MEN1 O00255 1/20 0.43
BRAF P15056 1/20 0.43
KMT2A Q03164 1/20 0.43
HKDC1 Q2TB90 1/20 0.43
HPGD P15428 1/20 0.42

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
SCHEMBL9930684 0.73 CCR2 (0.67) CCR2BRAF
SCHEMBL15037433 0.72 KEAP1 (0.53) MAPTNPSR1ALDH1A1ALDH3A1SMN1; SMN2
SCHEMBL15009060 0.72 ALDH1A1 (0.57) MAPTNPSR1ALDH1A1HTTALDH3A1
SCHEMBL6363753 0.71 MAPT (0.47) MAPTNPSR1ALDH1A1ALDH3A1KMT2A
SCHEMBL4966705 0.71 NR1H3 (0.50) MAPTALDH1A1HTTNPC1SMN1; SMN2
SCHEMBL15009245 0.71 MAPT (0.51) MAPTNPSR1ALDH1A1HTTCCR2
SCHEMBL15009688 0.70 ALDH1A1 (0.49) ALDH1A1HTTNPC1SMN1; SMN2TP53
SCHEMBL4969872 0.70 ALDH1A1 (0.49) MAPTALDH1A1HTTALDH3A1SMN1; SMN2
SCHEMBL31361989 0.69 MAPT (0.72) MAPTNPSR1ALDH1A1HTTSMN1; SMN2
SCHEMBL4969877 0.69 MEN1 (0.56) ALDH1A1HTTSMN1; SMN2TP53MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050288324-A1 Aromatic sulfonamides as peroxynitrite-rearrangement catalysts BLUME THORSTEN 2005-12-29 US claimed
US-20050288324-A1 Aromatic sulfonamides as peroxynitrite-rearrangement catalysts BLUME THORSTEN 2005-12-29 US disclosed
US-6946466-B2 Aromatic sulfonamides as peroxynitrite-rearrangement catalysts SCHERING AG (DE) 2005-09-20 US disclosed
WO-2004089882-A2 AROMATIC SULFONAMIDES AS PEROXYNITRITE-REARRANGEMENT CATALYSTS SCHERING AKTIENGESELLSCHAFT (DE) 2004-10-21 WO disclosed
US-20040204452-A1 Aromatic sulfonamides as peroxynitrite-rearrangement catalysts SCHERING AG (DE) 2004-10-14 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 (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-20050288324-A1 Aromatic sulfonamides as peroxynitrite-rearrangement catalysts SQOR, GSR, PPOX MAPT 2502/4885NPSR1 251/4885ALDH1A1 496/4885
US-20040204452-A1 Aromatic sulfonamides as peroxynitrite-rearrangement catalysts SQOR, NOX1, GSR MAPT 2315/4885NPSR1 281/4885ALDH1A1 391/4885

“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.