SCHEMBL2497987

SCHEMBL2497987

OC(F)(F)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.39
PDK2 Q15119 1/20 0.39
PDK3 Q15120 1/20 0.39
PDK4 Q16654 1/20 0.39
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30
TSHR P16473 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
SCHEMBL7670116 0.83
SCHEMBL91140 0.77 PDK1 (0.36) PDK1PDK2PDK3PDK4NR1H2
SCHEMBL12096882 0.77 PDK1 (0.36) PDK1PDK2PDK3PDK4NR1H2
SCHEMBL4777726 0.73 KEAP1 (0.38) KEAP1NFE2L2CES2CES1TSHR
SCHEMBL701478 0.73 KEAP1 (0.33) KEAP1NFE2L2CES2CES1TSHR
SCHEMBL7592777 0.73 KEAP1 (0.33) KEAP1NFE2L2CES2CES1TSHR
SCHEMBL237297 0.73 KEAP1 (0.33) KEAP1NFE2L2CES2CES1TSHR
SCHEMBL1287904 0.73 KEAP1 (0.33) KEAP1NFE2L2CES2CES1TSHR
SCHEMBL59958 0.73 NOS3 (0.32)
SCHEMBL22068846 0.73 NOS3 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996037540-A1 FOAMABLE COMPOSITION CONTAINING UNSATURATED PERFLUOROCHEMICAL BLOWING AGENT MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-11-28 WO claimed
EP-2158264-B1 BLENDS OF FLUOROALKYL-CONTAINING ESTER OLIGOMERS WITH POLYDICARBODIIMIDE(S) 3M INNOVATIVE PROPERTIES CO (US) 2019-04-10 EP disclosed
US-9828722-B2 Blends of fluoroalkyl-containing ester oligomers with polycarbodiimide(s) 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-11-28 US disclosed
EP-2935386-A1 POLYURETHANE POLYMER, SYNTHETIC LEATHER, AND METHOD 3M Innovative Properties Company (US) 2015-10-28 EP disclosed
US-20150176200-A1 BLENDS OF FLUOROALKYL-CONTAINING ESTER OLIGOMERS WITH POLYCARBODIIMIDE(S) 3M INNOVATIVE PROPERTIES CO (US) 2015-06-25 US disclosed
US-8993116-B2 Blends of fluoroalkyl-containing ester oligomers with polydicarbodiimide(S) 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-03-31 US disclosed
WO-2014099449-A1 POLYURETHANE POLYMER, SYNTHETIC LEATHER, AND METHOD 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-06-26 WO disclosed
US-20140170917-A1 POLYURETHANE POLYMER, SYNTHETIC LEATHER, AND METHOD 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-06-19 US disclosed
EP-1670839-B1 STAIN RESISTANT POLYURETHANE COATINGS 3M INNOVATIVE PROPERTIES CO (US) 2014-01-29 EP disclosed
US-8030430-B2 Oligimer comprised of polyfunctional isocyanate, polyol, perfluorocarbon derivatized monoalcohol and amine functionalized silanetriol combined with photostabilizer; durability, weatherability; uniform oil and water repellency 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-10-04 US disclosed
US-20050148726-A1 Stain resistant grout 3M INNOVATIVE PROPERTIES COMPANY 2005-07-07 US disclosed
US-20050075471-A1 Stain resistant polyurethane coatings 3M INNOVATIVE PROPERTIES COMPANY 2005-04-07 US disclosed
EP-1507916-A1 FLUOROCHEMICAL COMPOSITION FOR TREATMENT OF A FIBROUS SUBSTRATE 3M Innovative Properties Company (US) 2005-02-23 EP disclosed
US-6803109-B2 POLYURETHANES USEFUL AS COATINGS OR INCORPORATED AS MELT ADDITIVES WHICH IMPART STAIN RESISTANCE 3M INNOVATIVE PROPERTIES COMPANY 2004-10-12 US disclosed
US-6753380-B2 MAY BE APPLIED AS COATINGS OR INCORPORATED AS MELT ADDITIVES THE FLUOROCHEMICAL COMPOSITIONS IMPART OIL AND WATER REPELLENCY TO THE SUBSTRATE 3M INNOVATIVE PROPERTIES COMPANY 2004-06-22 US disclosed
WO-2003100157-A1 FLUOROCHEMICAL COMPOSITION FOR TREATMENT OF A FIBROUS SUBSTRATE 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-12-04 WO disclosed
US-6646088-B2 Composition comprising urethane oligomers, reaction product of polyfunctional isocyanate compounds, polyols, fluorocarbon monoalcohols and/or optionally substituted long-chain hydrocarbon monoalcohols, and reactive silanes 3M INNOVATIVE PROPERTIES COMPANY 2003-11-11 US disclosed
WO-2003082997-A1 URETHANE-BASED STAIN-RELEASE COATINGS 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-10-09 WO disclosed
US-20030105263-A1 Urethane-based stain-release coatings 3M INNOVATIVE PROPERTIES COMPANY 2003-06-05 US disclosed
WO-2002014443-A2 URETHANE-BASED STAIN-RELEASE COATINGS 3M INNOVATIVE PROPERTIES COMPANY (US) 2002-02-21 WO disclosed