SCHEMBL10000845

SCHEMBL10000845

C=CCOS(=O)(=O)/C=C/CCCCC

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
FAAH O00519 3/20 0.38
TRPV1 Q8NER1 1/20 0.37
PPARA Q07869 2/20 0.37
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL10000847 0.98 TSHR (0.44) TSHRFAAHTRPV1PPARA
SCHEMBL15221745 0.95 TSHR (0.40) TSHRFAAHTRPV1PPARAALDH1A1
SCHEMBL10000870 0.87 TSHR (0.36) TSHR
SCHEMBL10000839 0.82 FAAH (0.42) TSHRFAAHTRPV1PPARAALDH1A1
SCHEMBL10000838 0.80 FAAH (0.45) FAAHTRPV1PPARA
SCHEMBL11237451 0.80 FAAH (0.45) FAAHTRPV1PPARA
SCHEMBL4433583 0.80
SCHEMBL4433581 0.80
SCHEMBL4794606 0.77 FAAH (0.50) TSHRFAAHTRPV1PPARA
SCHEMBL4794612 0.77 FAAH (0.50) TSHRFAAHTRPV1PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9496585-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2016-11-15 US disclosed
US-9496585-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2016-11-15 US disclosed
US-20130224578-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2013-08-29 US disclosed
US-20130224578-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2013-08-29 US disclosed
WO-2012053485-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND NON-AQUEOUS ELECTROLYTE BATTERY USING SAME 三菱化学株式会社 (JP) 2012-04-26 WO disclosed