SCHEMBL6732747

SCHEMBL6732747

O=C(OCCOCC(F)(F)F)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.40
ALDH1A1 P00352 5/20 0.34
THRB P10828 1/20 0.34
EPHX2 P34913 1/20 0.33
TSHR P16473 3/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
HSD17B10 Q99714 1/20 0.31
PLA2G2C Q5R387 1/20 0.31

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
SCHEMBL16263370 0.85 HTT (0.39) HTTALDH1A1THRBEPHX2TSHR
SCHEMBL1589356 0.83 HTT (0.35) HTTALDH1A1
SCHEMBL22735038 0.82 HTT (0.43) HTTALDH1A1THRBEPHX2TSHR
SCHEMBL17736192 0.79 THRB (0.40) HTTALDH1A1THRBTSHRPLA2G2C
SCHEMBL668270 0.79 HTT (0.54) HTTALDH1A1TSHRHSD17B10
Ethylene SCHEMBL11404296 0.79 ALDH1A1 (0.32) HTTALDH1A1TSHRTP53HIF1A
SCHEMBL6730205 0.78 ALDH1A1 (0.56) HTTALDH1A1THRBEPHX2TSHR
SCHEMBL28726910 0.78 MEN1 (0.48) HTTALDH1A1THRBEPHX2TSHR
SCHEMBL9937107 0.78 ALDH1A1 (0.56) ALDH1A1THRBTSHRHSD17B10
SCHEMBL28726852 0.78 MEN1 (0.48) HTTALDH1A1THRBEPHX2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9472813-B2 Battery electrolyte solution containing certain ester-based solvents, and batteries containing such an electrolyte solution DOW GLOBAL TECHNOLOGIES LLC (US) 2016-10-18 US disclosed
CN-103262329-B Battery electrolyte solution containing certain ester-based solvents and battery containing such electrolyte solution DOW GLOBAL TECHNOLOGIES LLC (US) 2016-02-10 CN disclosed
EP-2652832-A1 BATTERY ELECTROLYTE SOLUTION CONTAINING CERTAIN ESTER-BASED SOLVENTS, AND BATTERIES CONTAINING SUCH AN ELECTROLYTE SOLUTION Dow Global Technologies LLC (US) 2013-10-23 EP disclosed
US-20130260229-A1 BATTERY ELECTROLYTE SOLUTION CONTAINING CERTAIN ESTER-BASED SOLVENTS, AND BATTERIES CONTAINING SUCH AN ELECTROLYTE SOLUTION DOW GLOBAL TECHNOLOGIES LLC (US) 2013-10-03 US disclosed
WO-2012082760-A1 BATTERY ELECTROLYTE SOLUTION CONTAINING CERTAIN ESTER-BASED SOLVENTS, AND BATTERIES CONTAINING SUCH AN ELECTROLYTE SOLUTION DOW GLOBAL TECHNOLOGIES LLC (US) 2012-06-21 WO disclosed
US-6677085-B2 SHORT CIRCUITING PREVENTION SOLVAY FLUOR UND DERIVATE GMBH (DE) 2004-01-13 US disclosed