SCHEMBL715241

SCHEMBL715241

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

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NT5E P21589 2/20 0.57
GAA P10253 2/20 0.53
THRB P10828 1/20 0.53
TDP1 Q9NUW8 4/20 0.52
CYP3A4 P08684 4/20 0.50
ALDH1A1 P00352 4/20 0.50
S1PR4 O95977 1/20 0.49
LMNA P02545 1/20 0.49
RAB9A P51151 1/20 0.49
TSHR P16473 2/20 0.49
ALOX15 P16050 2/20 0.49
CA2 P00918 4/20 0.48
CA1 P00915 3/20 0.48
CA5A P35218 2/20 0.48
CA12 O43570 2/20 0.48
CA9 Q16790 2/20 0.48
CA14 Q9ULX7 2/20 0.48
CA3 P07451 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 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
SCHEMBL315765 0.98 NT5E (0.59) NT5EGAATHRBTDP1CYP3A4
SCHEMBL67062 0.98 NT5E (0.59) NT5EGAATHRBTDP1CYP3A4
Ammonia Solution, Strong SCHEMBL5566240 0.96 NT5E (0.57) NT5EGAATHRBTDP1CYP3A4
SCHEMBL715238 0.96 NT5E (0.57) NT5EGAATHRBTDP1CYP3A4
Ammonia Solution, Strong SCHEMBL5566229 0.96 NT5E (0.57) NT5EGAATHRBTDP1CYP3A4
SCHEMBL715240 0.96 NT5E (0.57) NT5EGAATHRBTDP1CYP3A4
Fluoride SCHEMBL11674539 0.96 NT5E (0.57) NT5EGAATHRBTDP1CYP3A4
Ammonia Solution, Strong SCHEMBL29104708 0.95 NT5E (0.56) NT5EGAATHRBTDP1CYP3A4
SCHEMBL9636142 0.87 CYP3A4 (0.60) NT5EGAATHRBTDP1CYP3A4
SCHEMBL1485915 0.86 GAA (0.58) NT5EGAATHRBTDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114560848-A Reactive light/light-perspiration resistant composite color fastness improver and preparation method thereof 山东中康国创先进印染技术研究院有限公司 2022-05-31 CN claimed
CN-113200931-B Reactive light-sweat-resistant composite fastness improver and preparation method thereof 浙江理工大学上虞工业技术研究院有限公司 2022-05-13 CN claimed
CN-113200931-A Reactive light-sweat-resistant composite fastness improver and preparation method thereof 浙江理工大学上虞工业技术研究院有限公司 2021-08-03 CN claimed
CN-114560848-A Reactive light/light-perspiration resistant composite color fastness improver and preparation method thereof 山东中康国创先进印染技术研究院有限公司 2022-05-31 CN disclosed
CN-113200931-B Reactive light-sweat-resistant composite fastness improver and preparation method thereof 浙江理工大学上虞工业技术研究院有限公司 2022-05-13 CN disclosed
CN-113200931-A Reactive light-sweat-resistant composite fastness improver and preparation method thereof 浙江理工大学上虞工业技术研究院有限公司 2021-08-03 CN disclosed
EP-2038286-B1 PYRRO[1,2-B]PYRIDAZINONE COMPOUNDS ANADYS PHARMACEUTICALS INC (US) 2017-03-08 EP disclosed
US-8178271-B2 Polymer having a sulfonic group or a sulfonate group and an amide group and method of producing same CANON KABUSHIKI KAISHA (JP) 2012-05-15 US disclosed
US-20120050382-A1 INK JET INK COMPOSITION, INK JET RECORDING METHOD, INK CARTRIDGE, RECORDING UNIT, AND INK JET RECORDING APPARATUS SONY CORPORATION (JP) 2012-03-01 US disclosed
EP-2292670-A2 Charge control agent, toner, image forming method, and image forming apparatus Canon Kabushiki Kaisha (JP) 2011-03-09 EP disclosed
US-7842838-B2 Pyrro[1,2-b]pyridazinone intermediates ANADYS PHARMACEUTICALS, INC. (US) 2010-11-30 US disclosed
WO-2005121204-A2 POLYHYDROXYALKANOIC ACID HAVING VINYL, ESTER, CARBOXYL OR SULFONIC ACID GROUP AND PRODUCING METHOD THEREFOR CANON KABUSHIKI KAISHA (JP) 2005-12-22 WO disclosed
WO-2005121208-A1 POLYHYDROXYALKANOIC ACID HAVING ESTER, CARBOXYL OR SULFONIC ACID GROUP AND PRODUCING METHOD THEREFOR CANON KABUSHIKI KAISHA (JP) 2005-12-22 WO disclosed
WO-2005121206-A2 POLYHYDROXYALKANOATE HAVING VINYL GROUP, ESTER GROUP, CARBOXYL GROUP AND SULFONIC ACID GROUP, AND PRODUCTION METHOD THEREOF CANON KABUSHIKI KAISHA (JP) 2005-12-22 WO disclosed
WO-2005108441-A2 POLYMER HAVING A SULFONIC GROUP OR A SULFONATE GROUP AND AN AMIDE GROUP AND METHOD OF PRODUCING SAME CANON KABUSHIKI KAISHA (JP) 2005-11-17 WO disclosed
WO-2005103164-A1 SALTS OF LAKED MONOAZO COMPOUNDS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2005-11-03 WO disclosed
EP-1579276-A1 NOVEL POLYHYDROXYALKANOATE HAVING AMIDE, SULFONIC ACID OR SULFONATE ESTER GROUP, CHARGE CONTROL AGENT AND TONER CANON KABUSHIKI KAISHA (JP) 2005-09-28 EP disclosed
WO-2004061529-A1 NOVEL POLYHYDROXYALKANOATE HAVING AMIDE, SULFONIC ACID OR SULFONATE ESTER GROUP, CHARGE CONTROL AGENT AND TONER CANON KABUSHIKI KAISHA (JP) 2004-07-22 WO disclosed
US-3998957-A 1,1'-(UREYLENEBIS(SULFO-P-PHENYLENE)BISSULFO-1H,8H-INDAZOLO(2,3,4-CDE)BENZOTRIAZOL-9-IUM HYDROXIDE)INNER SALT AMERICAN CYANAMID COMPANY (US) 1976-12-21 US disclosed
US-3942987-A Photographic materials with ballasted, alkali cleavable azo dyes EASTMAN KODAK COMPANY 1976-03-09 US disclosed