SCHEMBL5077155

SCHEMBL5077155

O=S(=O)(O)c1ccc2ccccc2c1S(=O)(=O)O.[NaH].[NaH]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.51
CTRB1 P17538 1/20 0.51
MPL P40238 4/20 0.46
CTRC Q99895 2/20 0.46
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 3/20 0.42
CYP2A6 P11509 1/20 0.42
TSHR P16473 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HIF1A Q16665 2/20 0.41
CYP1B1 Q16678 1/20 0.41
TTR P02766 1/20 0.40
ERN1 O75460 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
ALOX15 P16050 1/20 0.40
ATIC P31939 1/20 0.40

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
SCHEMBL4314625 1.00 CYP2D6 (0.51) CYP2D6CTRB1MPLCTRCCA1
SCHEMBL3233245 1.00 CYP2D6 (0.51) CYP2D6CTRB1MPLCTRCCA1
Water SCHEMBL29022568 0.98 CTRB1 (0.50) CYP2D6CTRB1MPLCTRCCA1
SCHEMBL41541 0.98 CYP2D6 (0.53) CYP2D6CTRB1MPLCTRCCA1
SCHEMBL8835967 0.96 CYP2D6 (0.51) CYP2D6CTRB1MPLCTRCCA1
Hydrochloric Acid SCHEMBL251599 0.96 CTRB1 (0.55) CYP2D6CTRB1MPLCTRCCA1
Water SCHEMBL669870 0.96 CYP2D6 (0.51) CYP2D6CTRB1MPLCTRCCA1
SCHEMBL3233255 0.96 CYP2D6 (0.51) CYP2D6CTRB1MPLCTRCCA1
SCHEMBL4578484 0.96 CYP2D6 (0.51) CYP2D6CTRB1MPLCTRCCA1
SCHEMBL4897459 0.96 CYP2D6 (0.51) CYP2D6CTRB1MPLCTRCCA1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11543354-B2 Quantitative detection of non-fluorine anti-soil using a fluorescent trace indicator TARKETT USA INC. (US) 2023-01-03 US claimed
CN-109796638-A Rubber composition for tire and pneumatic tire 住友橡胶工业株式会社 2019-05-24 CN disclosed
CN-108925556-A Peroxycarboxylic acid compositions 艺康美国股份有限公司 2018-12-04 CN disclosed
EP-2574669-B1 BIOLOGICAL SAMPLE PRETREATMENT METHOD, METHOD FOR DETECTING RNA, AND PRETREATMENT KIT DNAFORM KK (JP) 2018-10-17 EP disclosed
CN-105188775-B Peroxycarboxylic acid compositions containing mineral acids for stabilization, anionic surfactants for defoaming and fluorescent active compounds for on-line optical or conductivity monitoring 艺康美国股份有限公司 2018-07-20 CN disclosed
CN-108026399-A Lithographic printing ink, lithographic plate ink varnish and the manufacture method using its printed article 东丽株式会社 2018-05-11 CN disclosed
US-9518901-B2 Pretreatment method of biological sample, detection method of RNA, and pretreatment kit KABUSHIKI KAISHA DNAFORM (JP) 2016-12-13 US disclosed
US-20160137916-A1 OPTICAL MATERIAL, OPTICAL FILM, AND LIGHT-EMITTING DEVICE Konica Minolta, Inc. (JP) 2016-05-19 US disclosed
CN-105188775-A Peroxycarboxylic acid compositions containing mineral acids for stabilization, anionic surfactants for defoaming and fluorescent active compounds for on-line optical or conductivity monitoring ECOLAB USA INC 2015-12-23 CN disclosed
US-20130302783-A1 PRETREATMENT METHOD OF BIOLOGICAL SAMPLE, DETECTION METHOD OF RNA, AND PRETREATMENT KIT KABUSHIKI KAISHA DNAFORM (JP) 2013-11-14 US disclosed
EP-2574669-A1 BIOLOGICAL SAMPLE PRETREATMENT METHOD, METHOD FOR DETECTING RNA, AND PRETREATMENT KIT Kabushiki Kaisha Dnaform (JP) 2013-04-03 EP disclosed
EP-1750827-A4 USE OF ANIONIC COPOLYMERS FOR ENHANCED RECOVERY OF USEFUL COAL AND POTASSIUM CHLORIDE FROM SCREEN BOWL CENTRIFUGE NALCO CO (US) 2008-10-22 EP disclosed
EP-1750827-A2 USE OF ANIONIC COPOLYMERS FOR ENHANCED RECOVERY OF USEFUL COAL AND POTASSIUM CHLORIDE FROM SCREEN BOWL CENTRIFUGE Nalco Company (US) 2007-02-14 EP disclosed
WO-2005118487-A2 USE OF ANIONIC COPOLYMERS FOR ENHANCED RECOVERY OF USEFUL COAL AND POTASSIUM CHLORIDE FROM SCREEN BOWL CENTRIFUGE NALCO COMPANY (US) 2005-12-15 WO 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-11543354-B2 Quantitative detection of non-fluorine anti-soil using a fluorescent trace indicator AFF2, AFF1, AFF4 CYP2D6 2733/4885CTRB1 4359/4885MPL 4881/4885

“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.