SCHEMBL1941394

SCHEMBL1941394

COc1cc([N+](=O)[O-])c(S(=O)(=O)O)cc1N.[NaH]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ PRKDC P78527 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ NSD2 O96028 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ PLCG1 P19174 1/20 0.44
▸ DNMT1 P26358 1/20 0.44
▸ CASP6 P55212 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ POLB P06746 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39

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
SCHEMBL343409 0.98 HTT (0.47) HTTALDH1A1TDP1KDM4ECYP3A4
SCHEMBL9354657 0.93 PKM (0.49) HTTALDH1A1TDP1KDM4ECYP3A4
SCHEMBL11744939 0.89 ALDH1A1 (0.51) HTTALDH1A1TDP1KDM4ECYP3A4
SCHEMBL11744950 0.89 ALDH1A1 (0.51) HTTALDH1A1TDP1KDM4ECYP3A4
SCHEMBL29798970 0.84 HTT (0.47) HTTALDH1A1TDP1KDM4ECYP3A4
SCHEMBL1941389 0.84 HTT (0.47) HTTALDH1A1TDP1KDM4ECYP3A4
SCHEMBL11610415 0.81 LMNA (0.46) HTTALDH1A1TDP1KDM4ECYP3A4
SCHEMBL343408 0.81 ALDH1A1 (0.43) HTTALDH1A1TDP1KDM4ECYP3A4
SCHEMBL11237924 0.81 GAA (0.45) HTTALDH1A1TDP1KDM4ECYP3A4
SCHEMBL7521818 0.81 GAA (0.45) HTTALDH1A1TDP1KDM4ECYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11739083-B2 Disposable sensor chip with reagent including 2-substituted benzothiazolyl-3-substituted phenyl-5-substituted sulfonated phenyl-2H-tetrazolium salt TERUMO KABUSHIKI KAISHA (JP) 2023-08-29 — — US disclosed
CN-109689648-B 2-substituted benzothiazolyl-3-substituted phenyl-5-substituted sulfonated phenyl-2H-tetrazolium salt 泰尔茂株式会社 2022-07-26 — — CN disclosed
US-20210009578-A1 DISPOSABLE SENSOR CHIP WITH REAGENT INCLUDING 2-SUBSTITUTED BENZOTHIAZOLYL-3-SUBSTITUTED PHENYL-5-SUBSTITUTED SULFONATED PHENYL-2H-TETRAZOLIUM SALT TERUMO KABUSHIKI KAISHA (JP) 2021-01-14 — — US disclosed
US-10851094-B2 2-substituted benzothiazolyl-3-substituted phenyl-5-substituted sulfonated phenyl-2H-tetrazolium salt, reagent for biological component concentration measurement containing said salt, and biological component concentration measurement method using said salt TERUMO KABUSHIKI KAISHA (JP) 2020-12-01 — — US disclosed
EP-3514156-A1 2-SUBSTITUTED BENZOTHIAZOLYL-3-SUBSTITUTED PHENYL-5-SUBSTITUTED SULFONATED PHENYL-2H-TETRAZOLIUM SALT, BIOLOGICAL COMPONENT CONCENTRATION MEASUREMENT REAGENT CONTAINING SAID SALT, AND BIOLOGICAL COMPONENT CONCENTRATION MEASUREMENT METHOD USING SAID SALT Terumo Kabushiki Kaisha (JP) 2019-07-24 — — EP disclosed
US-20190185465-A1 2-SUBSTITUTED BENZOTHIAZOLYL-3-SUBSTITUTED PHENYL-5-SUBSTITUTED SULFONATED PHENYL-2H-TETRAZOLIUM SALT, REAGENT FOR BIOLOGICAL COMPONENT CONCENTRATION MEASUREMENT CONTAINING SAID SALT, AND BIOLOGICAL COMPONENT CONCENTRATION MEASUREMENT METHOD USING SAID SALT TERUMO KABUSHIKI KAISHA (JP) 2019-06-20 — — US disclosed
EP-1734081-B1 AZO COMPOUND, INK COMPOSITION, AND COLORED OBJECT NIPPON KAYAKU KK (JP) 2011-06-15 — — EP disclosed
US-7503965-B2 Azo compound, ink composition, and colored object NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-03-17 — — US disclosed
US-20080292792-A1 Azo Compound, Ink Composition, and Colored Object NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2008-11-27 — — US disclosed
EP-1734081-A1 AZO COMPOUND, INK COMPOSITION, AND COLORED OBJECT Nippon Kayaku Kabushiki Kaisha (JP) 2006-12-20 — — EP 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-20210009578-A1 DISPOSABLE SENSOR CHIP WITH REAGENT INCLUDING 2-SUBSTITUTED BENZOTHIAZOLYL-3-SUBSTITUTED PHENYL-5-SUBSTITUTED SULFONATED PHENYL-2H-TETRAZOLIUM SALT STUB1, BTK, TST HTT 827/4885ALDH1A1 663/4885TDP1 2299/4885
US-10851094-B2 2-substituted benzothiazolyl-3-substituted phenyl-5-substituted sulfonated phenyl-2H-tetrazolium salt, reagent for biological component concentration measurement containing said salt, and biological component concentration measurement method using said salt BPNT1, EPB41, IL4 HTT 3008/4885ALDH1A1 1529/4885TDP1 3057/4885
US-11739083-B2 Disposable sensor chip with reagent including 2-substituted benzothiazolyl-3-substituted phenyl-5-substituted sulfonated phenyl-2H-tetrazolium salt STUB1, BTK, TST HTT 827/4885ALDH1A1 663/4885TDP1 2299/4885
US-20190185465-A1 2-SUBSTITUTED BENZOTHIAZOLYL-3-SUBSTITUTED PHENYL-5-SUBSTITUTED SULFONATED PHENYL-2H-TETRAZOLIUM SALT, REAGENT FOR BIOLOGICAL COMPONENT CONCENTRATION MEASUREMENT CONTAINING SAID SALT, AND BIOLOGICAL COMPONENT CONCENTRATION MEASUREMENT METHOD USING SAID SALT BPNT1, EPB41, IL4 HTT 3008/4885ALDH1A1 1529/4885TDP1 3057/4885

“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.

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