Linoleic Acid

Linoleic Acid

SCHEMBL9541584

CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.O=C1CCCN1

nearest known ligand 0.65

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.65
PPARD Q03181 6/20 0.65
PPARA Q07869 6/20 0.65
ALDH1A1 P00352 5/20 0.65
F7 P08709 5/20 0.65
F3 P13726 5/20 0.65
FABP4 P15090 4/20 0.65
HSD17B10 Q99714 4/20 0.65
FFAR1 O14842 3/20 0.65
PTGS1 P23219 3/20 0.65
LMNA P02545 3/20 0.65
CYP19A1 P11511 3/20 0.65
ALOX15 P16050 3/20 0.65
NR4A2 P43354 3/20 0.65
KDM4E B2RXH2 2/20 0.65
CYP3A4 P08684 2/20 0.65
HPGD P15428 2/20 0.65
AKR1C3 P42330 2/20 0.65
TDP1 Q9NUW8 2/20 0.65
DUSP3 P51452 2/20 0.65

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
Linoleic Acid SCHEMBL28260086 0.99 PPARG (0.63) PPARGPPARDPPARAALDH1A1F7
Oleic Acid SCHEMBL27528473 0.96 PPARG (0.62) PPARGPPARDPPARAALDH1A1F7
Oleic Acid SCHEMBL11134826 0.95 PPARG (0.60) PPARGPPARDPPARAALDH1A1F7
Oleic Acid SCHEMBL11134816 0.95 PPARG (0.60) PPARGPPARDPPARAALDH1A1F7
Stearic Acid SCHEMBL9387065 0.88 GPR84 (0.55) PPARGPPARDPPARAALDH1A1FABP4
Stearic Acid SCHEMBL1982539 0.87 GPR84 (0.53) PPARGPPARDPPARAALDH1A1FABP4
Hexanoate SCHEMBL7413873 0.87 AKR1B1 (0.53) PPARGPPARDPPARAALDH1A1FABP4
Undecanoate SCHEMBL28132949 0.83 GPR84 (0.52) PPARGPPARDPPARAALDH1A1FABP4
Myristic Acid SCHEMBL782903 0.83 GPR84 (0.52) PPARGPPARDPPARAALDH1A1FABP4
Linoleic Acid SCHEMBL160683 0.82 PPARG (0.96) PPARGPPARDPPARAALDH1A1F7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993011767-A1 TRANSDERMAL DELIVERY OF (E)-1,2,5,6-TETRAHYDRO-1-METHYL-3-PYRIDINE-CARBOXALDEHYDE-O-METHYLOXINE HCL AND RELATED COMPOUNDS IN THE TREATMENT OF COGNITIVE DISORDERS AND FOR ANALGESIA WARNER-LAMBERT COMPANY (US) 1993-06-24 WO disclosed