SCHEMBL2299704

SCHEMBL2299704

CCOC(=O)OCC(F)(F)C(F)C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
SOAT1 P35610 1/20 0.40
GAA P10253 2/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 2/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.31
ALOX15 P16050 1/20 0.31
MGAM O43451 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
KDM4E B2RXH2 1/20 0.30
PKM P14618 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
SCHEMBL3399500 1.00 ALDH1A1 (0.48) ALDH1A1SOAT1GAAPOLBLMNA
SCHEMBL2302416 0.90 HTT (0.37) ALDH1A1GAAPOLBHSD17B10HTT
SCHEMBL2297941 0.85 ALDH1A1 (0.52) ALDH1A1SOAT1GAAPOLBLMNA
SCHEMBL16985215 0.85 POLB (0.34) ALDH1A1GAAPOLBLMNAMEN1
SCHEMBL22735034 0.81 HTT (0.31) HTTTSHR
SCHEMBL14577296 0.79 ALDH1A1 (0.36) ALDH1A1GAAPOLBLMNAHSD17B10
SCHEMBL17413828 0.77 HTT (0.38) ALDH1A1GAAPOLBLMNAMEN1
SCHEMBL17413841 0.76 HTT (0.34) HTT
SCHEMBL2887866 0.76 HTT (0.35) ALDH1A1LMNAHSD17B10HTTTSHR
SCHEMBL575206 0.76 ALDH1A1 (0.62) ALDH1A1SOAT1GAALMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9406977-B2 Fluorinated compounds for use in lithium battery electrolytes 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-08-02 US disclosed
EP-2247686-B1 HEAT TRANSFER APPARATUS AND METHODS INCLUDING HYDROFLUOROCARBONATES 3M INNOVATIVE PROPERTIES CO (US) 2014-12-24 EP disclosed
EP-2637245-A1 Fluorinated compounds for use in lithium battery electrolytes 3M Innovative Properties Company (US) 2013-09-11 EP disclosed
US-20130224605-A1 FLUORINATED COMPOUNDS FOR USE IN LITHIUM BATTERY ELECTROLYTES 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-08-29 US disclosed
US-8435679-B2 Fluorinated compounds for use in lithium battery electrolytes 3M INNOVATIVE PROPERTIES COUNSEL (US) 2013-05-07 US disclosed
US-8003004-B2 Heat transfer apparatus and methods including hydrofluorocarbonates 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-08-23 US disclosed
US-20100104950-A1 FLUORINATED COMPOUNDS FOR USE IN LITHIUM BATTERY ELECTROLYTES GELION TECHNOLOGIES PTY LTD (AU) 2010-04-29 US disclosed
EP-2108209-A1 FLUORINATED COMPOUNDS FOR USE IN LITHIUM BATTERY ELECTROLYTES 3M Innovative Properties Company (US) 2009-10-14 EP disclosed
US-20090183856-A1 HEAT TRANSFER APPARATUS AND METHODS INCLUDING HYDROFLUOROCARBONATES 3M INNOVATIVE PROPERTIES COMPANY 2009-07-23 US disclosed
WO-2008079670-A1 FLUORINATED COMPOUNDS FOR USE IN LITHIUM BATTERY ELECTROLYTES 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-07-03 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-20100104950-A1 FLUORINATED COMPOUNDS FOR USE IN LITHIUM BATTERY ELECTROLYTES FLNB, FLNA, HCN2 ALDH1A1 1056/4885SOAT1 3035/4885GAA 2661/4885

“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.