SCHEMBL76110

SCHEMBL76110

O=S(=O)(OCC(F)(F)C(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 10/20 0.42
CA1 P00915 9/20 0.42
MMP1 P03956 3/20 0.34
MMP2 P08253 3/20 0.34
MMP9 P14780 3/20 0.34
MMP8 P22894 3/20 0.34
MMP13 P45452 3/20 0.34
F2 P00734 4/20 0.32
PRSS1 P07477 4/20 0.32
PRSS2 P07478 4/20 0.32
PRSS3 P35030 4/20 0.32

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
SCHEMBL2357198 0.92 CA2 (0.38) CA2CA1MMP1MMP2MMP9
SCHEMBL1551405 0.86 CA2 (0.40) CA2CA1MMP1MMP2MMP9
SCHEMBL22117313 0.81 CA2 (0.39) CA2CA1MMP1MMP2MMP9
SCHEMBL286439 0.80 CA2 (0.46) CA2CA1MMP1MMP2MMP9
SCHEMBL1758440 0.79 CA2 (0.45) CA2CA1MMP1MMP2MMP9
SCHEMBL75966 0.79 CA2 (0.45) CA2CA1MMP1MMP2MMP9
SCHEMBL977331 0.78 CA2 (0.34) CA2CA1
SCHEMBL25298036 0.77 CA2 (0.44) CA2CA1MMP1MMP2MMP9
SCHEMBL3027542 0.77 CA2 (0.44) CA2CA1MMP1MMP2MMP9
SCHEMBL15827020 0.77 CA2 (0.44) CA2CA1MMP1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113195674-A Hydrofluoroolefins and methods of use thereof 3M创新有限公司 2021-07-30 CN disclosed
WO-2020128964-A2 HYDROFLUOROOLEFINS AND METHODS OF USING SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-06-25 WO disclosed
EP-2349967-B1 METHODS OF MAKING FLUORINATED ETHERS, FLUORINATED ETHERS, AND USES THEREOF 3M INNOVATIVE PROPERTIES CO (US) 2016-03-23 EP disclosed
EP-2250700-B1 REDOX SHUTTLES FOR HIGH VOLTAGE CATHODES 3M INNOVATIVE PROPERTIES CO (US) 2014-09-17 EP disclosed
EP-2313365-B1 AQUEOUS METHODS FOR MAKING FLUORINATED SULFONATE ESTERS 3M INNOVATIVE PROPERTIES CO (US) 2013-11-06 EP disclosed
US-8350094-B2 Methods of making fluorinated ethers, fluorinated ethers, and uses thereof 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-01-08 US disclosed
EP-2496658-A2 METHODS OF USING HYDROFLUOROETHERS AS HEAT TRANSFER FLUIDS 3M Innovative Properties Company (US) 2012-09-12 EP disclosed
US-8261560-B2 Methods of using hydrofluoroethers as heat transfer fluids 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-09-11 US disclosed
US-8129412-B2 Hydantoin derivatives useful as metalloproteinase inhibitors ASTRAZENECA AB (SE) 2012-03-06 US disclosed
US-8101302-B2 Redox shuttles for high voltage cathodes 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-01-24 US disclosed
US-20100108934-A1 METHODS OF MAKING FLUORINATED ETHERS, FLUORINATED ETHERS, AND USES THEREOF 3M INNOVATIVE PROPERTIES COMPANY 2010-05-06 US disclosed
US-20100016624-A1 AQUEOUS METHODS FOR MAKING FLUORINATED SULFONATE ESTERS 3M INNOVATIVE PROPERTIES COMPANY 2010-01-21 US disclosed
US-20090286162-A1 REDOX SHUTTLES FOR HIGH VOLTAGE CATHODES 3M INNOVATIVE PROPERTIES COMPANY 2009-11-19 US disclosed
WO-2009102604-A1 REDOX SHUTTLES FOR HIGH VOLTAGE CATHODES 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-08-20 WO disclosed
EP-1828166-B1 HYDANTOIN DERIVATIVES USEFUL AS METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2009-07-22 EP disclosed
US-20080280950-A1 Hydantoin Derivatives Useful as Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2008-11-13 US disclosed
EP-1828166-A1 HYDANTOIN DERIVATIVES USEFUL AS METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2007-09-05 EP disclosed
WO-2006064218-A1 HYDANTOIN DERIVATIVES USEFUL AS METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2006-06-22 WO disclosed
US-6768025-B2 FOR CONTROLLING BROADLEAF AND GRASS WEEDS IN CROPS AVENTIS CROPSCIENCE GMBH (DE) 2004-07-27 US disclosed
US-20030060651-A1 Benzoylcyclohexanedione derivatives and their use as herbicides BAYER CROPSCIENCE GMBH (DE) 2003-03-27 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 (2 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-20080280950-A1 Hydantoin Derivatives Useful as Metalloproteinase Inhibitors MMP3, MMP9, MMP2 CA2 130/4885CA1 236/4885MMP1 9/4885
US-20030060651-A1 Benzoylcyclohexanedione derivatives and their use as herbicides DDT, CBR3, CBR1 CA2 336/4885CA1 1232/4885MMP1 3058/4885

“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.