SCHEMBL9937353

SCHEMBL9937353

CCOCCOC(=O)C(C)F

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
TSHR P16473 2/20 0.56
THRB P10828 1/20 0.48
HSD17B10 Q99714 3/20 0.41
GAA P10253 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL9936957 0.88 TSHR (0.42) ALDH1A1TSHRTHRBHSD17B10SMN1; SMN2
SCHEMBL9936848 0.84 ALDH1A1 (0.58) ALDH1A1TSHRTHRBHSD17B10GAA
SCHEMBL10233231 0.82 ALDH1A1 (0.60) ALDH1A1TSHRTHRBHSD17B10GAA
SCHEMBL4676252 0.82 ALDH1A1 (0.60) ALDH1A1TSHRTHRBHSD17B10GAA
SCHEMBL4392241 0.81 ALDH1A1 (0.34) ALDH1A1TSHRTHRBHSD17B10MEN1
SCHEMBL879162 0.80 ALDH1A1 (0.58) ALDH1A1TSHRTHRBHSD17B10GAA
SCHEMBL3792746 0.80 ALDH1A1 (0.58) ALDH1A1TSHRTHRBHSD17B10GAA
SCHEMBL16021805 0.80 ALDH1A1 (0.58) ALDH1A1TSHRTHRBHSD17B10GAA
SCHEMBL22591380 0.79
SCHEMBL4400532 0.79 ALDH1A1 (0.38) ALDH1A1TSHRTHRBHSD17B10MEN1

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 4 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
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