SCHEMBL4756040

SCHEMBL4756040

CS(=O)(=O)Oc1ccccc1C(=O)Nc1ncc([N+](=O)[O-])s1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.73
KMT2A Q03164 9/20 0.73
RAB9A P51151 9/20 0.73
NPC1 O15118 8/20 0.73
STAT3 P40763 7/20 0.73
PKM P14618 4/20 0.73
MAPT P10636 3/20 0.73
ALDH1A1 P00352 2/20 0.73
LMNA P02545 2/20 0.73
HTT P42858 2/20 0.73
SMN1; SMN2 Q16637 2/20 0.73
NPSR1 Q6W5P4 2/20 0.73
MLNR O43193 1/20 0.73
NR1I2 O75469 1/20 0.73
ABCB11 O95342 1/20 0.73
TP53 P04637 1/20 0.73
ADRB2 P07550 1/20 0.73
CHRM2 P08172 1/20 0.73
ADRB1 P08588 1/20 0.73
CYP3A4 P08684 1/20 0.73

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
SCHEMBL19512170 0.90 MEN1 (0.72) MEN1KMT2ARAB9ANPC1STAT3
SCHEMBL19512169 0.88 MEN1 (0.68) MEN1KMT2ARAB9ANPC1STAT3
SCHEMBL19512174 0.87 RAB9A (0.67) MEN1KMT2ARAB9ANPC1STAT3
SCHEMBL12994083 0.86 NPC1 (0.79) MEN1KMT2ARAB9ANPC1STAT3
SCHEMBL19512176 0.86 MEN1 (0.66) MEN1KMT2ARAB9ANPC1STAT3
SCHEMBL19528610 0.85 MEN1 (0.65) MEN1KMT2ARAB9ANPC1STAT3
Nitazoxanide SCHEMBL5055353 0.84 STAT3 (1.00) MEN1KMT2ARAB9ANPC1STAT3
Nitazoxanide SCHEMBL40981 0.84 STAT3 (1.00) MEN1KMT2ARAB9ANPC1STAT3
Nitazoxanide SCHEMBL29373905 0.84 STAT3 (1.00) MEN1KMT2ARAB9ANPC1STAT3
SCHEMBL27134627 0.84 MEN1 (0.76) MEN1KMT2ARAB9ANPC1STAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170362261-A1 Tizoxanide Phosphate and Alkane Sulfonate and Pharmaceutical Applications Thereof INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. CHINA (CN) 2017-12-21 US claimed
EP-3239160-A1 TIZOXANIDE PHOSPHATE AND ALKANE SULFONATE AND PHARMACEUTICAL APPLICATIONS THEREOF Institute of Pharmacology and Toxicology Academy of Military Medical Sciences P.L.A. China (CN) 2017-11-01 EP claimed
US-10196411-B2 Tizoxanide phosphate and alkane sulfonate and pharmaceutical applications thereof INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. CHINA (CN) 2019-02-05 US disclosed
US-10196411-B2 Tizoxanide phosphate and alkane sulfonate and pharmaceutical applications thereof INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. CHINA (CN) 2019-02-05 US disclosed
US-20170362261-A1 Tizoxanide Phosphate and Alkane Sulfonate and Pharmaceutical Applications Thereof INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. CHINA (CN) 2017-12-21 US disclosed
US-20170362261-A1 Tizoxanide Phosphate and Alkane Sulfonate and Pharmaceutical Applications Thereof INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. CHINA (CN) 2017-12-21 US disclosed
US-20170362261-A1 Tizoxanide Phosphate and Alkane Sulfonate and Pharmaceutical Applications Thereof INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. CHINA (CN) 2017-12-21 US disclosed
EP-3239160-A1 TIZOXANIDE PHOSPHATE AND ALKANE SULFONATE AND PHARMACEUTICAL APPLICATIONS THEREOF Institute of Pharmacology and Toxicology Academy of Military Medical Sciences P.L.A. China (CN) 2017-11-01 EP disclosed
EP-3239160-A1 TIZOXANIDE PHOSPHATE AND ALKANE SULFONATE AND PHARMACEUTICAL APPLICATIONS THEREOF Institute of Pharmacology and Toxicology Academy of Military Medical Sciences P.L.A. China (CN) 2017-11-01 EP disclosed
US-8895752-B2 Alkylsulfonyl-substituted thiazolide compounds ROMARK LABORATORIES L.C. (US) 2014-11-25 US disclosed
US-8895752-B2 Alkylsulfonyl-substituted thiazolide compounds ROMARK LABORATORIES L.C. (US) 2014-11-25 US disclosed
US-20120122939-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS ROMARK LABORATORIES, L.C. 2012-05-17 US disclosed
US-20120122939-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS ROMARK LABORATORIES, L.C. 2012-05-17 US disclosed
US-8124632-B2 Alkylsulfonyl-substituted thiazolide compounds ROMARK LABORATORIES, L.C. (US) 2012-02-28 US disclosed
US-8124632-B2 Alkylsulfonyl-substituted thiazolide compounds ROMARK LABORATORIES, L.C. (US) 2012-02-28 US disclosed
US-20090036467-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS ROMARK LABORATORIES L.C. 2009-02-05 US disclosed
US-20090036467-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS ROMARK LABORATORIES L.C. 2009-02-05 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 (4 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-10196411-B2 Tizoxanide phosphate and alkane sulfonate and pharmaceutical applications thereof TPI1, ALK, STS MEN1 4147/4885KMT2A 3483/4885RAB9A 3060/4885
US-20120122939-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS HAVCR2, EIF2AK2, AADAC MEN1 4564/4885KMT2A 2303/4885RAB9A 1694/4885
US-20170362261-A1 Tizoxanide Phosphate and Alkane Sulfonate and Pharmaceutical Applications Thereof TPI1, ALK, STS MEN1 4147/4885KMT2A 3483/4885RAB9A 3060/4885
US-20090036467-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS HAVCR2, EIF2AK2, AADAC MEN1 4564/4885KMT2A 2303/4885RAB9A 1694/4885

“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.