SCHEMBL21097694

SCHEMBL21097694

c1ccc(/N=N/C(=N\Nc2nc3ccccc3s2)c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 3/20 0.55
ALDH1A1 P00352 2/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
HIF1A Q16665 1/20 0.55
RAB9A P51151 11/20 0.50
NPC1 O15118 8/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MEN1 O00255 9/20 0.49
KMT2A Q03164 9/20 0.49
SMN1; SMN2 Q16637 8/20 0.49
GAA P10253 6/20 0.48
LMNA P02545 2/20 0.48
HPGD P15428 1/20 0.48
ALOX12 P18054 1/20 0.48
MAPT P10636 8/20 0.48
PKM P14618 1/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48

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
SCHEMBL11332710 1.00 HSP90AA1 (0.55) HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A
SCHEMBL11327597 1.00 HSP90AA1 (0.55) HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A
SCHEMBL11514771 0.89 HSP90AA1 (0.47) HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A
SCHEMBL11324389 0.88 HSP90AA1 (0.46) HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A
SCHEMBL11324393 0.88 HSP90AA1 (0.46) HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A
SCHEMBL11412155 0.84 ALDH1A1 (0.61) HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A
SCHEMBL11412162 0.84 ALDH1A1 (0.61) HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A
SCHEMBL9007939 0.83 HSP90AA1 (0.57) HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A
SCHEMBL9007943 0.83 HSP90AA1 (0.57) HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A
SCHEMBL11510969 0.80 HSP90AA1 (0.53) HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11815448-B2 Method, reagent, and chip for measuring analyte concentration in specimen TERUMO KABUSHIKI KAISHA (JP) 2023-11-14 US disclosed
US-11815448-B2 Method, reagent, and chip for measuring analyte concentration in specimen TERUMO KABUSHIKI KAISHA (JP) 2023-11-14 US disclosed
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
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
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
US-20200371020-A1 METHOD, REAGENT, AND CHIP FOR MEASURING ANALYTE CONCENTRATION IN SPECIMEN TERUMO KABUSHIKI KAISHA (JP) 2020-11-26 US 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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 HSP90AA1 806/4885ALDH1A1 663/4885CYP1A2 4048/4885
US-20200371020-A1 METHOD, REAGENT, AND CHIP FOR MEASURING ANALYTE CONCENTRATION IN SPECIMEN STUB1, MPO, ALDH1A2 HSP90AA1 3391/4885ALDH1A1 15/4885CYP1A2 121/4885
US-11815448-B2 Method, reagent, and chip for measuring analyte concentration in specimen STUB1, MPO, ALDH1A2 HSP90AA1 3391/4885ALDH1A1 15/4885CYP1A2 121/4885
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 HSP90AA1 2239/4885ALDH1A1 1529/4885CYP1A2 2404/4885
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 HSP90AA1 806/4885ALDH1A1 663/4885CYP1A2 4048/4885
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 HSP90AA1 2239/4885ALDH1A1 1529/4885CYP1A2 2404/4885

“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.