SCHEMBL668513

SCHEMBL668513

O=[N+]([O-])c1cc([N+](=O)[O-])cc(S(=O)(=O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.52
GAA P10253 2/20 0.52
NSD2 O96028 1/20 0.52
PLCG1 P19174 1/20 0.52
DNMT1 P26358 1/20 0.52
CASP6 P55212 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
HTT P42858 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP3A4 P08684 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CA2 P00918 4/20 0.46
CA1 P00915 3/20 0.46
MMP1 P03956 2/20 0.46
MMP2 P08253 2/20 0.46
MMP9 P14780 2/20 0.46
MMP8 P22894 2/20 0.46
MMP13 P45452 2/20 0.46
CA5A P35218 2/20 0.46
LMNA P02545 3/20 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
SCHEMBL28543490 0.98 GAA (0.50) CYP19A1GAANSD2PLCG1DNMT1
SCHEMBL11228135 0.95 GAA (0.52) CYP19A1GAANSD2PLCG1DNMT1
SCHEMBL11221366 0.93 GAA (0.50) CYP19A1GAANSD2PLCG1DNMT1
SCHEMBL3202730 0.88 GAA (0.50) CYP19A1GAANSD2PLCG1DNMT1
SCHEMBL1024318 0.86 ACP1 (0.50) CYP19A1GAANSD2PLCG1DNMT1
SCHEMBL6355256 0.86 GAA (0.53) GAANSD2PLCG1DNMT1CASP6
SCHEMBL14902037 0.86 TSHR (0.61) CYP19A1GAANSD2PLCG1DNMT1
Sulfuric Acid SCHEMBL2943116 0.85 CYP19A1 (0.62) CYP19A1GAAL3MBTL1HTTKMT2A
SCHEMBL2820721 0.85 ACP1 (0.49) CYP19A1GAANSD2PLCG1DNMT1
SCHEMBL4360179 0.85 CYP3A4 (0.47) GAANSD2PLCG1DNMT1CASP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119153690-A Secondary battery, negative electrode plate and electricity utilization device 宁德时代新能源科技股份有限公司 2024-12-17 CN claimed
CN-114188583-A Composite proton exchange membrane and preparation method and application thereof 中汽创智科技有限公司 2022-03-15 CN claimed
US-10725055-B1 Compounds for carbonyl sulfide/carbon disulfide/hydrogen sulfide release and methods of making and using the same UNIVERSITY OF OREGON (US) 2020-07-28 US claimed
CN-111004565-A TMMGU system extinction outdoor weather-resistant powder coating 安徽省华安进出口有限公司 2020-04-14 CN claimed
CN-107151475-B A kind of powdery paints of the dry-mixed additive of powdery paints and its offer grain effect 安徽省华安进出口有限公司 2019-09-13 CN claimed
CN-109486373-A A kind of weather resistant low brightness pool powdery paints 安徽省华安进出口有限公司 2019-03-19 CN claimed
US-10034387-B2 Method for recycling of obsolete printed circuit boards ENTEGRIS, INC. (US) 2018-07-24 US claimed
CN-107151475-A A kind of powdery paints dry-mixed additive and its powdery paints of offer grain effect 安徽省华安进出口有限公司 2017-09-12 CN claimed
US-9731368-B2 Apparatus and method for stripping solder metals during the recycling of waste electrical and electronic equipment ENTEGRIS, INC. (US) 2017-08-15 US claimed
US-9649712-B2 Apparatus and method for stripping solder metals during the recycling of waste electrical and electronic equipment ENTEGRIS, INC. (US) 2017-05-16 US claimed
US-20170079146-A1 METHOD FOR RECYCLING OF OBSOLETE PRINTED CIRCUIT BOARDS ADVANCED TECH MATERIALS (US) 2017-03-16 US claimed
CN-106460182-A Plating bath composition and method for electroless plating of palladium 安美特德国有限公司 2017-02-22 CN claimed
EP-2790845-B1 APPARATUS AND METHOD FOR STRIPPING SOLDER METALS DURING THE RECYCLING OF WASTE ELECTRICAL AND ELECTRONIC EQUIPMENT ENTEGRIS INC (US) 2017-02-08 EP claimed
US-20160122846-A1 SUSTAINABLE PROCESS FOR RECLAIMING PRECIOUS METALS AND BASE METALS FROM E-WASTE ENTEGRIS, INC. 2016-05-05 US claimed
US-20160095230-A1 METHOD FOR RECYCLING OF OBSOLETE PRINTED CIRCUIT BOARDS ENTEGRIS, INC. 2016-03-31 US claimed
CN-105274338-A Sustainable process for reclaiming precious metals and base metals from e-waste ADVANCED TECH MATERIALS 2016-01-27 CN claimed
US-9221114-B2 Apparatus and method for stripping solder metals during the recycling of waste electrical and electronic equipment ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2015-12-29 US claimed
US-9215813-B2 Method for recycling of obsolete printed circuit boards ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2015-12-15 US claimed
CN-102560467-A Highly corrosion-resistant galvanized black passivating agent and preparation method thereof JINAN DILIGENCE TECHNOLOGY CO LTD 2012-07-11 CN claimed
EP-0562877-A2 Cell fixative and method of staining cells without destroying the cell surface ORTHO DIAGNOSTIC SYSTEMS INC. (a New Jersey corp.) (US) 1993-09-29 EP 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 (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-10725055-B1 Compounds for carbonyl sulfide/carbon disulfide/hydrogen sulfide release and methods of making and using the same CBS, SQOR, TST CYP19A1 3143/4885GAA 2369/4885NSD2 1017/4885

“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.