Dodecanoate

Dodecanoate

SCHEMBL6765876

CCCCCCCCCCCC(=O)O.O=C(c1ccccc1)c1ccccc1

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.64
CES1 P23141 2/20 0.64
PPARA Q07869 8/20 0.63
GPR84 Q9NQS5 7/20 0.63
PPARG P37231 7/20 0.63
PPARD Q03181 7/20 0.63
HDAC11 Q96DB2 6/20 0.63
TSHR P16473 4/20 0.63
PTPN1 P18031 3/20 0.63
ALDH1A1 P00352 3/20 0.63
TLR2 O60603 2/20 0.63
TDP1 Q9NUW8 2/20 0.63
FABP4 P15090 2/20 0.63
KMT2A Q03164 2/20 0.63
SLC22A6 Q4U2R8 1/20 0.63
SLC22A8 Q8TCC7 1/20 0.63
MEN1 O00255 1/20 0.63
ESR1 P03372 1/20 0.63
ALOX15 P16050 1/20 0.63
PDE4A P27815 1/20 0.63

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
Stearic Acid SCHEMBL6765166 1.00 CES2 (0.64) CES2CES1PPARAGPR84PPARG
Stearic Acid SCHEMBL28330158 0.98 CES2 (0.62) CES2CES1PPARAGPR84PPARG
Stearic Acid SCHEMBL6765873 0.92 HSD17B3 (0.61) CES2CES1PPARAGPR84PPARG
Dodecanoate SCHEMBL6767044 0.92 HSD17B3 (0.61) CES2CES1PPARAGPR84PPARG
Stearic Acid SCHEMBL9065925 0.91 HSD17B3 (0.59) CES2CES1PPARAGPR84PPARG
Tetradecane SCHEMBL27879974 0.90 ALDH1A1 (0.64) CES2CES1ALDH1A1TDP1MAPT
Benzophenone SCHEMBL28860378 0.90 ALDH1A1 (0.64) CES2CES1ALDH1A1TDP1MAPT
Benzophenone SCHEMBL27879973 0.90 ALDH1A1 (0.64) CES2CES1ALDH1A1TDP1MAPT
Octanoic Acid SCHEMBL6051069 0.89 CES2 (0.64) CES2CES1PPARAGPR84PPARG
Heptanoate SCHEMBL5788520 0.89 CES2 (0.64) CES2CES1PPARAGPR84PPARG

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
CN-106025156-B A kind of lithium ion battery nanometer plasticizing porous polyethylene dry-stretched membrane and preparation method thereof 河南师范大学 2019-05-14 CN claimed
CN-106025156-A Nano plasticized porous polyethylene dry-stretched film for lithium ion batteries and preparation method thereof 河南师范大学 2016-10-12 CN claimed
CN-109071977-A PRINTING FORMULATIONS AND METHODS 维罗斯-纯粹数字有限公司 2018-12-21 CN disclosed
US-20040033380-A1 Process for the manufacture of thermoplastic shrink films SYFAN SAAD (99) LTD. (IL) 2004-02-19 US disclosed
EP-1355976-A1 IMPROVED PROCESS FOR THE MANUFACTURE OF THERMOPLASTIC SHRINK FILMS Syfan Saad (99) Ltd. (IL) 2003-10-29 EP disclosed
WO-2002051913-A1 IMPROVED PROCESS FOR THE MANUFACTURE OF THERMOPLASTIC SHRINK FILMS SYFAN SAAD (99) LTD. (IL) 2002-07-04 WO disclosed