SCHEMBL71840

SCHEMBL71840

Cc1ccc(S(=O)(=O)OCCF)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.45
CA1 P00915 3/20 0.45
CA9 Q16790 3/20 0.45
CA12 O43570 2/20 0.45
ALDH1A1 P00352 5/20 0.43
STAT3 P40763 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
CA2 P00918 2/20 0.42
CA3 P07451 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
AGER Q15109 1/20 0.42
VDR P11473 1/20 0.41
TLR9 Q9NR96 1/20 0.41
CYP2D6 P10635 2/20 0.40
CYP1A2 P05177 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
SCHEMBL2757584 1.00 GAA (0.45) GAACA1CA9CA12ALDH1A1
SCHEMBL5605462 0.96 CA12 (0.43) GAACA1CA9CA12ALDH1A1
SCHEMBL28459992 0.95 ALDH1A1 (0.46) GAACA1CA9CA12ALDH1A1
SCHEMBL499508 0.90 ALDH1A1 (0.46) GAACA1CA9CA12ALDH1A1
SCHEMBL484303 0.90 ALDH1A1 (0.46) GAACA1CA9CA12ALDH1A1
SCHEMBL13020456 0.89 ALDH1A1 (0.44) GAACA1CA9CA12ALDH1A1
SCHEMBL57036 0.89 ALDH1A1 (0.44) GAACA1CA9CA12ALDH1A1
SCHEMBL241884 0.88 CA1 (0.52) GAACA1CA9CA12ALDH1A1
SCHEMBL3838686 0.87 ALDH1A1 (0.43) GAACA1CA9CA12ALDH1A1
SCHEMBL8402278 0.86 ALDH1A1 (0.42) GAACA1CA9CA12ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117865858-A Novel PET imaging agent targeting cannabinoid type 2 receptor, preparation method and application thereof 浙江大学 2024-04-12 CN claimed
CN-117199523-A Electrolyte, secondary battery and electric equipment 欣旺达动力科技股份有限公司 2023-12-08 CN claimed
US-11242314-B2 Synthesizing pet tracers using [F-18]sulfonyl fluoride as a source of [F-18]fluoride WASHINGTON UNIVERSITY (US) 2022-02-08 US claimed
CN-111233834-B FAK-targeting compound and markers thereof, and preparation methods and applications of FAK-targeting compound and markers 北京师范大学 2021-08-31 CN claimed
CN-112778838-A Inorganic nano material printing ink and preparation method thereof 广东绿展科技有限公司 2021-05-11 CN claimed
US-20170197912-A1 SYNTHESIZING PET TRACERS USING [F-18]SULFONYL FLUORIDE AS A SOURCE OF [F-18]FLUORIDE WASHINGTON UNIVERSITY (US) 2017-07-13 US claimed
CN-105461708-A Quinazoline tyrosine kinase inhibitor, and preparation method and application thereof SHANGHAI SUN-SAIL PHARMACEUTICAL SCIENCE & TECH CO LTD 2016-04-06 CN claimed
US-20150367005-A1 METHOD OF SYNTHESIZING FLUORINE-18 LABELED RADIOPHARMACEUTICALS IN ETHANOL AND WATER THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2015-12-24 US claimed
CN-101709060-B F-triazole ring-polyethylene glycol-metronidazole compound and preparation method thereof UNIV BEIJING NORMAL 2013-05-01 CN claimed
CN-101648899-B New synthetic method of PET imaging agent L-5-18FETP PEKING UNION MEDICAL COLLEGE HOSPITAL CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2012-02-22 CN claimed
CN-101709060-A F-triazole ring-polyethylene glycol-metronidazole compound and preparation method thereof UNIV BEIJING NORMAL 2010-05-19 CN claimed
CN-101648899-A New synthetic method of PET imaging agent L-5-<18>FETP PEKING UNION MEDICAL COLLEGE H 2010-02-17 CN claimed
WO-2008132211-A1 AMINO-QUINAZOLINONE DERIVATIVES FOR USE AS RADIOTRACERS AND IMAGING AGENTS NOVARTIS AG (CH) 2008-11-06 WO claimed
EP-0195135-B1 A PROCESS FOR THE PREPARATION OF QUINOLINE CARBOXYLIC ACID DERIVATIVES KYORIN SEIYAKU KABUSHIKI KAISHA (JP) 1992-06-17 EP claimed
WO-2026098672-A1 BIAZACYCLOALKANE MENIN-MLL PROTEIN INHIBITORS, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF 赛诺哈勃药业(成都)有限公司 2026-05-15 WO disclosed
EP-3687551-B1 FLUORO SUBSTITUTED PORPHYRIN COMPOUNDS, PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME, AND METHODS OF PREPARING AND USING THE SAME UNIV DUKE (US) 2026-04-15 EP disclosed
EP-4713330-A1 TRICYCLIC COMPOUNDS AND USES THEREOF HUTCHMED Limited (CN) 2026-03-25 EP disclosed
EP-0031237-B1 QUINAZOLINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, COMPOSITIONS CONTAINING THEM AND THEIR USE AS ANTI-CANCER AGENTS NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1984-10-17 EP disclosed
US-4382937-A Naphthyridine derivatives and their use as anti-bacterials DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1983-05-10 US disclosed
EP-0031237-A1 Quinazoline derivatives, processes for their preparation, compositions containing them and their use as anti-cancer agents NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1981-07-01 EP 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 (3 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-20170197912-A1 SYNTHESIZING PET TRACERS USING [F-18]SULFONYL FLUORIDE AS A SOURCE OF [F-18]FLUORIDE STX18, GPR119, SLC5A1 GAA 268/4885CA1 881/4885CA9 307/4885
US-11242314-B2 Synthesizing pet tracers using [F-18]sulfonyl fluoride as a source of [F-18]fluoride STX18, GPR119, SLC5A1 GAA 268/4885CA1 881/4885CA9 307/4885
US-20150367005-A1 METHOD OF SYNTHESIZING FLUORINE-18 LABELED RADIOPHARMACEUTICALS IN ETHANOL AND WATER TMEM14C, ADH1A, SELENOI GAA 1392/4885CA1 978/4885CA9 724/4885

“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.