SCHEMBL109690

SCHEMBL109690

N#[N+]c1ccc(C(=O)O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.60
TP53 P04637 1/20 0.60
SRD5A2 P31213 4/20 0.52
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA12 O43570 1/20 0.50
CA3 P07451 1/20 0.50
TYR P14679 1/20 0.50
DRD1 P21728 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA5A P35218 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
ALDH1A1 P00352 2/20 0.48
ALOX15 P16050 1/20 0.48
TPMT P51580 1/20 0.48
SMN1; SMN2 Q16637 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
Hydrochloric Acid SCHEMBL741554 0.98 TSHR (0.57) TSHRTP53SRD5A2CA1CA2
SCHEMBL240289 0.91 TSHR (0.50) TSHRTP53SRD5A2CA1CA2
Terephthalic Acid SCHEMBL5014892 0.81 TSHR (0.92) TSHRTP53SRD5A2CA1CA2
SCHEMBL111501 0.79 ALDH1A1 (0.61) TSHRTP53SRD5A2ALDH1A1ALOX15
SCHEMBL5050889 0.79 KDM4E (0.50) TSHRTP53CA1CA2CA12
SCHEMBL6260247 0.78 PARP10 (0.48) TSHRCA1CA2CA12CA9
Terephthalic Acid SCHEMBL25175830 0.78 TSHR (0.86) TSHRTP53SRD5A2CA1CA2
Terephthalic Acid SCHEMBL31248123 0.78 TSHR (0.86) TSHRTP53SRD5A2CA1CA2
Terephthalic Acid SCHEMBL175823 0.78 TSHR (1.00) TSHRTP53SRD5A2CA1CA2
Terephthalic Acid SCHEMBL1655 0.78 TSHR (1.00) TSHRTP53SRD5A2CA1CA2

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 241 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216524-A1 Chemoselective Rapid Azo-Coupling Reaction for Bioconjugation TRUSTEES BOSTON COLLEGE (US) 2024-07-04 US claimed
US-11890351-B2 Chemoselective rapid azo-coupling reaction for bioconjugation TRUSTEES OF BOSTON COLLEGE (US) 2024-02-06 US claimed
CN-116375600-A Aryl triazene compound, synthesis method thereof and application thereof in preparation of antitumor drugs 广州药本君安医药科技股份有限公司 2023-07-04 CN claimed
WO-2021232109-A1 BIOANALYTE DETECTION AND MONITORING COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2021-11-25 WO claimed
EP-3820629-A1 PROCESS FOR FORMING A POLYMERIC ORGANIC FILM AT THE SURFACE OF A METAL SUBSTRATE USING A GEL Commissariat à l'énergie atomique et aux énergies alternatives (FR) 2021-05-19 EP claimed
CN-110261455-A A kind of aptamers electrochemical sensor 山西大学 2019-09-20 CN claimed
CN-110243903-A A kind of application method of aptamers electrochemical sensor 山西大学 2019-09-17 CN claimed
CN-106932591-B A kind of non-marked electrochemica biological sensor and cell factor real-time detection method based on aptamers detection cell factor 华中师范大学 2019-05-24 CN claimed
US-20180360984-A1 Chemoselective Rapid Azo-Coupling Reaction for Bioconjugation TRUSTEES OF BOSTON COLLEGE 2018-12-20 US claimed
EP-3077127-B1 ADHESION PRIMER FOR PAINT COMMISSARIAT ENERGIE ATOMIQUE (FR) 2018-11-14 EP claimed
EP-1989345-A1 METHOD OF FORMING ORGANIC FILMS ON ELECTRICALLY CONDUCTING OR SEMICONDUCTING SURFACES FROM AQUEOUS SOLUTIONS COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2008-11-12 EP claimed
WO-2008078052-A2 METHOD FOR PREPARING AN ORGANIC FILM AT THE SURFACE OF A SOLID SUBSTRATEIN NON-ELECTROCHEMICAL CONDITIONS, SOLID SUBSTRATE THUS FORMED AND PREPARATION KIT COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2008-07-03 WO claimed
WO-2008043918-A2 TWO-STEP METHOD FOR FORMING ORGANIC FILMS ON ELECTRICALLY CONDUCTING SURFACES FROM AQUEOUS SOLUTIONS COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2008-04-17 WO claimed
JP-2007530781-A 2007-11-01 JP claimed
WO-2007099218-A1 METHOD OF FORMING ORGANIC FILMS ON ELECTRICALLY CONDUCTING OR SEMICONDUCTING SURFACES FROM AQUEOUS SOLUTIONS COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2007-09-07 WO claimed
US-7229668-B2 Process for the electrochemical production of a carbon-containing material whose surface is modified with organic groups, and use of the modified material CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2007-06-12 US claimed
CN-1946875-A Method for selectively coating a surface of a composite material, microelectronic interconnect fabrication and integrated circuits using the same ALCHIMER (FR) 2007-04-11 CN claimed
EP-1759038-A2 METHOD FOR SELECTIVE COATING OF A COMPOSITE SURFACE PRODUCTION OF MICROELECTRONIC INTERCONNECTIONS USING SAID METHOD AND INTEGRATED CIRCUITS Alchimer S.A. (FR) 2007-03-07 EP claimed
WO-2005098087-A2 METHOD FOR SELECTIVE COATING OF A COMPOSITE SURFACE PRODUCTION OF MICROELECTRONIC INTERCONNECTIONS USING SAID METHOD AND INTEGRATED CIRCUITS ALCHIMER (FR) 2005-10-20 WO claimed
WO-1992013983-A1 PROCESS FOR MODIFYING THE SURFACE OF CARBON-CONTAINING MATERIALS BY ELECTROCHEMICAL REDUCTION OF DIAZONIUM SALTS, APPLICABLE IN PARTICULAR TO CARBON FIBRES FOR COMPOSITE MATERIALS; CARBON-CONTAINING MATERIALS SO MODIFIED CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 1992-08-20 WO claimed

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

For each of this compound's patents that has machine-readable text (3 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-20240216524-A1 Chemoselective Rapid Azo-Coupling Reaction for Bioconjugation PAICS, DNPEP, ABCG2 TSHR 1453/4885TP53 665/4885SRD5A2 4006/4885
US-20180360984-A1 Chemoselective Rapid Azo-Coupling Reaction for Bioconjugation PAICS, DNPEP, ABCG2 TSHR 1453/4885TP53 665/4885SRD5A2 4006/4885
US-11890351-B2 Chemoselective rapid azo-coupling reaction for bioconjugation PAICS, DNPEP, ABCG2 TSHR 1453/4885TP53 665/4885SRD5A2 4006/4885

“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.