SCHEMBL5485447

SCHEMBL5485447

COC(C)C(C)OC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
TP53 P04637 1/20 0.32
HCAR2 Q8TDS4 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
SCHEMBL1936262 0.88 TSHR (0.40) TSHRTP53HCAR2
SCHEMBL1470228 0.80 TSHR (0.35) TSHR
SCHEMBL17563231 0.80 TSHR (0.35) TSHR
SCHEMBL17563230 0.80 TSHR (0.35) TSHR
SCHEMBL17563229 0.80 TSHR (0.35) TSHR
SCHEMBL1953128 0.79 TSHR (0.31) TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL1469973 0.78 SMN1; SMN2 (0.33) TSHR
SCHEMBL9626093 0.78 TSHR (0.52) TSHR
SCHEMBL222174 0.77
SCHEMBL9704864 0.77 TSHR (0.36) TSHRTP53HCAR2

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
CN-113461533-A Diesel oil cleaning component based on carbonic acid diether ester and application thereof 中国人民解放军火箭军工程大学 2021-10-01 CN disclosed
US-9231274-B2 Nonaqueous electrolyte solution and lithium secondary battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2016-01-05 US disclosed
US-20130196225-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2013-08-01 US disclosed
US-20070224514-A1 Nonaqueous Electrolyte Solution and Lithium Secondary Battery Using Same MITSUBISHI CHEMICAL CORPORATION (JP) 2007-09-27 US disclosed