Linoleic Acid

Linoleic Acid

SCHEMBL28754753

CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCO.OO

nearest known ligand 0.93

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Linoleic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.93
PPARD Q03181 6/20 0.93
PPARA Q07869 6/20 0.93
ALDH1A1 P00352 5/20 0.93
F7 P08709 5/20 0.93
F3 P13726 5/20 0.93
FABP4 P15090 4/20 0.93
HSD17B10 Q99714 4/20 0.93
FFAR1 O14842 3/20 0.93
PTGS1 P23219 3/20 0.93
LMNA P02545 3/20 0.93
CYP19A1 P11511 3/20 0.93
ALOX15 P16050 3/20 0.93
NR4A2 P43354 3/20 0.93
KDM4E B2RXH2 2/20 0.93
CYP3A4 P08684 2/20 0.93
HPGD P15428 2/20 0.93
AKR1C3 P42330 2/20 0.93
TDP1 Q9NUW8 2/20 0.93
DUSP3 P51452 2/20 0.93

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 SCHEMBL27343411 1.00 PPARG (0.93) PPARGPPARDPPARAALDH1A1F7
Linoleic Acid SCHEMBL5482954 1.00 PPARG (0.93) PPARGPPARDPPARAALDH1A1F7
Gamolenic Acid SCHEMBL27823852 0.98 PPARG (0.93) PPARGPPARDPPARAALDH1A1F7
SCHEMBL21411004 0.96 PPARG (1.00) PPARGPPARDPPARAALDH1A1F7
Arachidic Acid SCHEMBL20528087 0.96 PPARG (1.00) PPARGPPARDPPARAALDH1A1F7
Linoleic Acid SCHEMBL25294178 0.96 PPARG (1.00) PPARGPPARDPPARAALDH1A1F7
Dihomo-Gamma-Linolenic Acid SCHEMBL20656585 0.96 PPARG (1.00) PPARGPPARDPPARAALDH1A1F7
SCHEMBL22498256 0.96 PPARG (1.00) PPARGPPARDPPARAALDH1A1F7
SCHEMBL22498258 0.96 PPARG (1.00) PPARGPPARDPPARAALDH1A1F7
SCHEMBL18605771 0.96 PPARG (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114588271-B Metal-medicine full-active nano medicine and preparation method and application thereof 北京理工大学 2024-01-09 CN disclosed
CN-114588271-A Metal-drug full-activity nano-drug and preparation method and application thereof 北京理工大学 2022-06-07 CN disclosed