SCHEMBL98173

SCHEMBL98173

FC(F)(F)[S+](c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KIF11 P52732 1/20 0.35
CES1 P23141 2/20 0.33
PTPN1 P18031 1/20 0.32
CALM1 P0DP23 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA5A P35218 1/20 0.31
CA9 Q16790 1/20 0.31
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 1/20 0.30

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
SCHEMBL1060855 0.92 ALDH1A1 (0.36) TSHRALDH1A1KIF11CES1
Trifluoromethanesulfonic Acid SCHEMBL6708430 0.82 GPR3 (0.47) PTPN1CA1CA2CA5ACA9
SCHEMBL12411029 0.81 CYP2A6 (0.39) ALDH1A1CES1PTPN1CA1CA2
SCHEMBL9944391 0.78 PTGS1 (0.42) ALDH1A1CA1CA2
Trifluoromethanesulfonic Acid SCHEMBL7911698 0.75 GPR3 (0.41) TSHRALDH1A1PTPN1
SCHEMBL98413 0.75 KDM4E (0.32) ALDH1A1
SCHEMBL12411023 0.75 ALDH1A1 (0.34) TSHRALDH1A1
SCHEMBL2436976 0.73 TSHR (0.43) TSHRALDH1A1KIF11CES1PTPN1
SCHEMBL6708331 0.72 ALDH1A1 (0.33) TSHRALDH1A1
SCHEMBL12411038 0.72 ACHE (0.42) TSHRALDH1A1CA1CA2CA5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025059074-A1 BICYCLIC COMPOUNDS FOR RESTORING MUTANT P53 FUNCTION PMV PHARMACEUTICALS, INC. (US) 2025-03-20 WO disclosed
EP-4522591-A1 OXOINDOLINYL AMIDE DERIVATIVES FOR INHIBITING NLRP3 AND USES THEREOF Ventus Therapeutics U.S., Inc. (US) 2025-03-19 EP disclosed
CN-119654326-A Novel heterocyclic compounds 豪夫迈·罗氏有限公司 2025-03-18 CN disclosed
CN-119212978-A Oxoindolinyl amide derivatives for inhibiting NLRP3 and use thereof 万特斯治疗美国公司 2024-12-27 CN disclosed
EP-4479403-A1 MEMBRANE-ASSOCIATED TYROSINE-AND THREONINE-SPECIFIC CDC2-INHIBITORY KINASE (PKMYT1) INHIBITORS AND USES THEREOF Insilico Medicine IP Limited (HK) 2024-12-25 EP disclosed
US-20240368131-A1 OXOINDOLINYL AMIDE DERIVATIVES FOR INHIBITING NLRP3 AND USES THEREOF VENTUS THERAPEUTICS U S INC (US) 2024-11-07 US disclosed
CN-118900840-A Membrane-associated tyrosine and threonine-specific CDC2 inhibitor kinase (PKMYT 1) inhibitors and uses thereof 英矽智能科技知识产权有限公司 2024-11-05 CN disclosed
EP-4413001-A1 PARG INHIBITORY COMPOUNDS FoRx Therapeutics AG (CH) 2024-08-14 EP disclosed
US-20240240066-A1 REACTIVE ADHESIVE TAPE THAT CAN BE STAMPED TESA SE (DE) 2024-07-18 US disclosed
CN-117777895-A Curable pressure sensitive adhesives with improved adhesive properties 德莎欧洲股份公司 2024-03-29 CN disclosed
US-20100035185-A1 Compound for Photoacid Generator, Resist Composition Using the Same, and Pattern-Forming Method CENTRAL GLASS COMPANY, LTD. (JP) 2010-02-11 US disclosed
EP-2151443-A1 POLYHEDRAL POLYSILOXANE MODIFIED PRODUCT AND COMPOSITION USING THE MODIFIED PRODUCT Kaneka Corporation (JP) 2010-02-10 EP disclosed
US-7649118-B2 Process for preparing fluorine-containing norbornene derivative DAIKIN INDUSTRIES, LTD. (JP) 2010-01-19 US disclosed
US-7511179-B2 Fluorine-containing polymer, resist composition prepared from same and novel fluorine-containing monomer DAIKIN INDUSTRIES, LTD. (JP) 2009-03-31 US disclosed
US-20090081589-A1 THICK FILM RESISTS MERCK PATENT GMBH (DE) 2009-03-26 US disclosed
US-7414148-B2 Process for producing alkoxycarbonylfluoroalkanesulfonates CENTRAL GLASS COMPANY LIMITED (JP) 2008-08-19 US disclosed
US-20080108846-A1 PROCESS FOR PRODUCING ALKOXYCARBONYLFLUOROALKANESULFONATES CENTRAL GLASS COMPANY, LIMITED (JP) 2008-05-08 US disclosed
US-20070129576-A1 Process for preparing fluorine-containing norbornene derivative DAIKIN INDUSTRIES, LTD. 2007-06-07 US disclosed
US-7186773-B2 Process for preparing fluorine-containing norbornene derivative DAIKIN INDUSTRIES, LTD. (JP) 2007-03-06 US disclosed
US-6215021-B1 TRIFLUOROMETHYL DIPHENYLSULFONIUM TRIFLATE DERIVATIVES IDAHO RESEARCH FOUNDATION, INC. 2001-04-10 US 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 (4 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-20080108846-A1 PROCESS FOR PRODUCING ALKOXYCARBONYLFLUOROALKANESULFONATES ARSA, PFAS, MPST TSHR 3426/4885ALDH1A1 713/4885KIF11 2514/4885
US-20100035185-A1 Compound for Photoacid Generator, Resist Composition Using the Same, and Pattern-Forming Method ASIC1, RER1, INSRR TSHR 1202/4885ALDH1A1 1210/4885KIF11 2588/4885
US-20240368131-A1 OXOINDOLINYL AMIDE DERIVATIVES FOR INHIBITING NLRP3 AND USES THEREOF NLRP3, NLRP1, NOD1 TSHR 4782/4885ALDH1A1 4026/4885KIF11 3824/4885
US-20070129576-A1 Process for preparing fluorine-containing norbornene derivative ADH1A, FLNA, FFAR2 TSHR 839/4885ALDH1A1 154/4885KIF11 1119/4885

“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.