SCHEMBL14740485

SCHEMBL14740485

CCCCCc1ccc(C=CB(O)OC(C)(C)C(C)(C)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 4/20 0.43
LIPG Q9Y5X9 4/20 0.43
TRPV1 Q8NER1 1/20 0.42
MGLL Q99685 1/20 0.42
TNNC1 P63316 3/20 0.40
SPHK2 Q9NRA0 1/20 0.40
SPHK1 Q9NYA1 1/20 0.40
TRPM2 O94759 2/20 0.39
TRPA1 O75762 1/20 0.39
PLA2G1B P04054 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
ESR1 P03372 2/20 0.39
ADRA2A P08913 2/20 0.39
ADORA3 P0DMS8 2/20 0.39
TACR2 P21452 2/20 0.39
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39

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
SCHEMBL1627257 0.76 CA1 (0.48) TRPV1MGLLTRPA1CYP3A4ALDH1A1
SCHEMBL12502085 0.76 LPL (0.58) LPLLIPGTRPV1MGLLTNNC1
SCHEMBL18343467 0.73 LPL (0.54) LPLLIPGTRPV1MGLLTNNC1
SCHEMBL29954685 0.73 CA1 (0.55) LPLLIPGTRPV1MGLLSPHK2
SCHEMBL15194641 0.72 CA1 (0.56) LPLLIPGTRPV1MGLLESR1
SCHEMBL8852659 0.71 LPAR2 (0.30)
SCHEMBL28788008 0.68 ESR1 (0.55) LPLLIPGTRPV1MGLLTNNC1
Boric Acid SCHEMBL27995448 0.68 CA1 (0.49) LPLLIPGTRPV1MGLLESR1
SCHEMBL14739789 0.68 PTGS1 (0.38) PTGS1PTGS2
SCHEMBL27876015 0.68 TNNC1 (0.62) LPLLIPGTRPV1MGLLTNNC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130059210-A1 ELECTROLYTE FOR RECHARGEABLE LITHIUM BATTERY AND RECHARGEABLE LITHIUM BATTERY INCLUDING SAME SAMSUNG SDI CO., LTD. (KR) 2013-03-07 US claimed
US-20130059210-A1 ELECTROLYTE FOR RECHARGEABLE LITHIUM BATTERY AND RECHARGEABLE LITHIUM BATTERY INCLUDING SAME SAMSUNG SDI CO., LTD. (KR) 2013-03-07 US disclosed