SCHEMBL67062

SCHEMBL67062

Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NT5E P21589 2/20 0.59
GAA P10253 2/20 0.55
THRB P10828 1/20 0.55
TDP1 Q9NUW8 4/20 0.53
ALDH1A1 P00352 6/20 0.52
CYP3A4 P08684 4/20 0.52
TSHR P16473 2/20 0.50
ALOX15 P16050 2/20 0.50
S1PR4 O95977 1/20 0.50
LMNA P02545 1/20 0.50
RAB9A P51151 1/20 0.50
HTT P42858 1/20 0.47
CYP2C19 P33261 1/20 0.47
PDE2A O00408 1/20 0.46
PDE5A O76074 1/20 0.46
NFKB1 P19838 1/20 0.46
APEX1 P27695 1/20 0.46
PDE4A P27815 1/20 0.46
BLM P54132 1/20 0.46
PDE1B Q01064 1/20 0.46

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
SCHEMBL315765 1.00 NT5E (0.59) NT5EGAATHRBTDP1ALDH1A1
Ammonia Solution, Strong SCHEMBL5566240 0.98 NT5E (0.57) NT5EGAATHRBTDP1ALDH1A1
Ammonia Solution, Strong SCHEMBL5566229 0.98 NT5E (0.57) NT5EGAATHRBTDP1ALDH1A1
Fluoride SCHEMBL11674539 0.98 NT5E (0.57) NT5EGAATHRBTDP1ALDH1A1
SCHEMBL715241 0.98 NT5E (0.57) NT5EGAATHRBTDP1ALDH1A1
SCHEMBL715240 0.98 NT5E (0.57) NT5EGAATHRBTDP1ALDH1A1
SCHEMBL715238 0.98 NT5E (0.57) NT5EGAATHRBTDP1ALDH1A1
Ammonia Solution, Strong SCHEMBL29104708 0.96 NT5E (0.56) NT5EGAATHRBTDP1ALDH1A1
SCHEMBL1485915 0.87 GAA (0.58) NT5EGAATHRBTDP1ALDH1A1
SCHEMBL9636142 0.85 CYP3A4 (0.60) NT5EGAATHRBTDP1ALDH1A1

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 1023 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116603464-B High-density epoxy resin microcapsule and preparation method and application thereof 武汉中科先进材料科技有限公司 2024-01-02 CN claimed
CN-116603464-A High-density epoxy resin microcapsule and preparation method and application thereof 武汉中科先进材料科技有限公司 2023-08-18 CN claimed
CN-116103711-A Forward and reverse pulse electrolytic nickel-phosphorus alloy solution, preparation method, electroplating method and nickel-phosphorus alloy coating 安徽智备工业科技有限公司 2023-05-12 CN claimed
CN-111752098-A Self-luminous photosensitive resin composition, color filter and image display device 常州强力电子新材料股份有限公司 2020-10-09 CN claimed
CN-105051010-B Prepare the new method of N (aminosulfonylphenyl of 4 nitro 2) malonamic acid methyl esters and N (aminosulfonylphenyl of 4 amino 2) malonamic acid methyl esters 豪夫迈·罗氏有限公司 2017-07-28 CN claimed
EP-2943468-B1 A NOVEL PROCESS FOR THE PREPARATION OF N-(4-NITRO-2-SULFAMOYL-PHENYL)-MALONAMIC ACID METHYL ESTER AND N-(4-AMINO-2-SULFAMOYL-PHENYL)-MALONAMIC ACID METHYL ESTER HOFFMANN LA ROCHE (CH) 2017-03-01 EP claimed
EP-2943468-A2 A NOVEL PROCESS FOR THE PREPARATION OF N-(4-NITRO-2-SULFAMOYL-PHENYL)-MALONAMIC ACID METHYL ESTER AND N-(4-AMINO-2-SULFAMOYL-PHENYL)-MALONAMIC ACID METHYL ESTER F.HOFFMANN-LA ROCHE AG (CH) 2015-11-18 EP claimed
CN-105051010-A A novel process for the preparation of n-(4-nitro-2-sulfamoyl-phenyl)-malonamic acid methyl ester and n-(4-amino-2-sulfamoyl-phenyl)-malonamic acid methyl ester HOFFMANN LA ROCHE 2015-11-11 CN claimed
US-8816120-B2 Process for the preparation of N-(4-nitro-2-sulfamoyl-phenyl)-malonamic acid methyl ester and N-(4-amino-2-sulfamoyl-phenyl)-malonamic acid methyl ester HOFFMANN-LA ROCHE INC. (US) 2014-08-26 US claimed
WO-2014108806-A2 A NOVEL PROCESS FOR THE PREPARATION OF N-(4-NITRO-2-SULFAMOLY-PHENYL)-MALONAMIC ACID METHYL ESTER AND N-(4-AMINO-2-SULFAMOYL-PHENYL)-MALONAMIC ACID METHYL ESTER F. HOFFMANN-LA ROCHE AG (CH) 2014-07-17 WO claimed
CN-1946809-A Salts of laked monoazo compounds CIBA SC HOLDING AG (CH) 2007-04-11 CN claimed
EP-1758957-A1 SALTS OF LAKED MONOAZO COMPOUNDS CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2007-03-07 EP claimed
WO-2005103164-A1 SALTS OF LAKED MONOAZO COMPOUNDS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2005-11-03 WO claimed
EP-0429614-B1 AZOPHENYL COMPOUNDS JAMES ROBINSON LTD (GB) 1995-10-11 EP claimed
EP-0429614-A1 AZOPHENYL COMPOUNDS. JAMES ROBINSON LTD (GB) 1991-06-05 EP claimed
WO-1990015850-A1 AZOPHENYL COMPOUNDS JAMES ROBINSON LIMITED (GB) 1990-12-27 WO claimed
EP-0346827-A1 Process and composition for producing protective and colour-receptive coatings on aluminium Lea Manufacturing Company (US) 1989-12-20 EP claimed
EP-0140252-B1 POLYAZO DYES BASF Aktiengesellschaft (DE) 1988-01-07 EP claimed
EP-0140252-A2 Polyazo dyes BASF Aktiengesellschaft (DE) 1985-05-08 EP claimed
US-4114369-A MULTILAYER SHEET OF METAL FOILS, INTUMESCENT MATERIAL AND GLASS CLOTH REINFORCEMENT THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1978-09-19 US claimed