SCHEMBL7513754

SCHEMBL7513754

Cc1c([N+](=O)[O-])cc(S(=O)(=O)O)cc1[N+](=O)[O-]

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.61
GAA P10253 1/20 0.61
PLCG1 P19174 1/20 0.61
DNMT1 P26358 1/20 0.61
CASP6 P55212 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
ALDH1A1 P00352 5/20 0.51
TDP1 Q9NUW8 2/20 0.51
HPGD P15428 1/20 0.51
KMT2A Q03164 2/20 0.50
CA12 O43570 4/20 0.47
CA1 P00915 4/20 0.47
CA2 P00918 4/20 0.47
CA9 Q16790 4/20 0.47
CCR6 P51684 1/20 0.44
CYP1A2 P05177 1/20 0.44
MCOLN3 Q8TDD5 2/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
GPR35 Q9HC97 1/20 0.44

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
SCHEMBL10477302 0.98 NSD2 (0.59) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL10477303 0.98 NSD2 (0.59) NSD2GAAPLCG1DNMT1CASP6
Hydrochloric Acid SCHEMBL10477341 0.98 NSD2 (0.59) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL10626481 0.89 NSD2 (0.58) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL2810591 0.88 NSD2 (0.53) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL27857014 0.88 NSD2 (0.53) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL10883681 0.88 CASP6 (0.71) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL11681535 0.83 VCAM1 (0.55) GAAALDH1A1TDP1KMT2ACA12
SCHEMBL28251898 0.83 CASP6 (0.65) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL10628283 0.82 CASP6 (0.79) NSD2GAAPLCG1DNMT1CASP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170283787-A1 METHOD FOR NON-ENZYMATIC COMBINATION OF NUCLEIC ACID CHAINS JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2017-10-05 US disclosed
US-7211696-B2 Antileishmanial dinitroaniline sulfanomides with activity against parasite tubulin THE OHIO STATE UNIVERSITY (US) 2007-05-01 US disclosed
EP-1172691-A1 Method of processing photographic silver-dye-bleach materials and bleaching solution preparations therefor ILFORD Imaging Switzerland GmbH (CH) 2002-01-16 EP disclosed
CN-1314906-A Salts of paroxetine SMITHKLINE BEECHAM PLC (GB) 2001-09-26 CN disclosed
US-4879413-A PHOTOGRAPHIC BLEACHING CIBA-GEIGY AG (CH) 1989-11-07 US disclosed
US-4797427-A ESTERIFICATION, HYDROGENATION BAYER AKTIENGESELLSCHAFT (DE) 1989-01-10 US disclosed
EP-0288824-A2 Aromatic diamines containing sulfonic acid esters, process for their preparation and their use for the preparation of polyurethane polymers BAYER AG (DE) 1988-11-02 EP disclosed
US-4701525-A Polyazo dyestuffs having high UV absorption CIBA-GEIGY AG (CH) 1987-10-20 US disclosed
EP-0133163-B1 METHOD OF PROCESSING PHOTOGRAPHIC SILVER DYE-BLEACHING MATERIALS CIBA-GEIGY AG (CH) 1987-08-26 EP disclosed
US-4609609-A ULTRAVIOLET CIBA GEIGY AG (CH) 1986-09-02 US disclosed
EP-0037030-A1 Aromatic diamines containing sulphon amide groups BAYER AG (DE) 1981-10-07 EP disclosed
EP-0034793-A2 Method of processing photographic silver dye bleaching materials, compositions suitable for it and their preparation from concentrates or partial concentrates, the concentrates and partial concentrates CIBA-GEIGY AG (CH) 1981-09-02 EP disclosed
US-4266011-A FUSED PYRIDAZINE CATALYST CIBA-GEIGY AG (CH) 1981-05-05 US disclosed
EP-0014688-A2 Process for the treatment of silver dye-bleaching materials, aqueous preparation therefor, concentrate and process for making the preparation CIBA-GEIGY AG (CH) 1980-08-20 EP disclosed
US-4216320-A Quinoxaline bleach catalysts CIBA-GEIGY AG (CH) 1980-08-05 US disclosed
US-4202698-A DYE BLEACH CATALYSTS CIBA-GEIGY AG (CH) 1980-05-13 US disclosed
US-4145217-A DYE BLEACH CATALYST CIBA-GEIGY AG (CH) 1979-03-20 US disclosed
US-4125402-A Method of processing silver dye bleaching materials and preparations suitable for the dye and silver bleaching CIBA-GEIGY AG (CH) 1978-11-14 US disclosed
US-4014698-A ACIDS, IODIDE COMPOUNDS, OXIDIZERS, DIAZINE COMPOUND CIBA-GEIGY AG (CH) 1977-03-29 US disclosed
US-4003953-A 2,4,6-TRINITRO-TOLUENE; HEATING, DISSOLVING THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1977-01-18 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 (1 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-20170283787-A1 METHOD FOR NON-ENZYMATIC COMBINATION OF NUCLEIC ACID CHAINS RNGTT, POLRMT, DNTT NSD2 3860/4885GAA 207/4885PLCG1 1920/4885

“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.