SCHEMBL27949697

SCHEMBL27949697

CCC(=O)OC(CCCCCCCCC(=O)O)CCCCCCCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.50
FFAR1 O14842 2/20 0.50
ALDH1A1 P00352 3/20 0.49
GPR84 Q9NQS5 7/20 0.47
PPARG P37231 7/20 0.47
PPARD Q03181 7/20 0.47
PPARA Q07869 7/20 0.47
HDAC11 Q96DB2 5/20 0.47
TSHR P16473 5/20 0.47
PTPN1 P18031 3/20 0.47
TLR2 O60603 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
FABP4 P15090 2/20 0.47
SLC22A6 Q4U2R8 1/20 0.47
SLC22A8 Q8TCC7 1/20 0.47
MEN1 O00255 1/20 0.47
ESR1 P03372 1/20 0.47
ALOX15 P16050 1/20 0.47
PDE4A P27815 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL4204493 0.95 FFAR4 (0.59) FFAR4FFAR1ALDH1A1GPR84PPARG
SCHEMBL4201646 0.92 MAPK1 (0.58) FFAR4FFAR1ALDH1A1GPR84PPARG
SCHEMBL18041136 0.91 MAPT (0.53) FFAR4FFAR1ALDH1A1GPR84PPARG
SCHEMBL4201641 0.89 FFAR4 (0.71) FFAR4FFAR1ALDH1A1GPR84PPARG
SCHEMBL25297686 0.86 MAPK1 (0.64) FFAR4FFAR1ALDH1A1GPR84PPARG
SCHEMBL23288413 0.86 MAPK1 (0.64) FFAR4FFAR1ALDH1A1GPR84PPARG
SCHEMBL2154198 0.86 MAPK1 (0.64) FFAR4FFAR1ALDH1A1GPR84PPARG
SCHEMBL23565739 0.86 MAPK1 (0.64) FFAR4FFAR1ALDH1A1GPR84PPARG
SCHEMBL22589987 0.86 MAPK1 (0.64) FFAR4FFAR1ALDH1A1GPR84PPARG
SCHEMBL215669 0.86 MAPK1 (0.64) FFAR4FFAR1ALDH1A1GPR84PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105950259-A ESTERS FOR USE AS A BASE STOCK AND IN LUBRICANT APPLICATIONS 特伦特大学 2016-09-21 CN disclosed
CN-103492356-B Esters as base oils and their use in lubricants TRENT UNIVERSITY (CA) 2016-03-02 CN disclosed
CN-103492356-A Esters as base oils and their use in lubricants TRENT UNIVERSITY 2014-01-01 CN disclosed