SCHEMBL9937598

SCHEMBL9937598

CCOCCOC(=O)CC(F)F

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
TSHR P16473 3/20 0.52
THRB P10828 1/20 0.46
HSD17B10 Q99714 2/20 0.35
DGKA P23743 1/20 0.35
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
EPHX2 P34913 1/20 0.33
NAAA Q02083 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TRPA1 O75762 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL9937021 0.89 ALDH1A1 (0.39) ALDH1A1TSHRTHRBDGKAMGAM
SCHEMBL22115777 0.82 ALDH1A1 (0.54) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL24161250 0.81 NAAA (0.39) ALDH1A1TSHRDGKANAAATDP1
SCHEMBL973553 0.81
SCHEMBL22115742 0.80 TSHR (0.52) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL9936197 0.79 TSHR (0.38) ALDH1A1TSHRHSD17B10DGKACYP3A4
SCHEMBL22115789 0.78 ALDH1A1 (0.50) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL22115737 0.78 TSHR (0.50) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL6328626 0.78 ALDH1A1 (0.46) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL6322471 0.78 ALDH1A1 (0.46) ALDH1A1TSHRTHRBHSD17B10DGKA

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
CN-103262329-A Battery electrolyte solution containing certain ester-based solvents and battery containing such electrolyte solution DOW GLOBAL TECHNOLOGIES INC 2013-08-21 CN 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