Oleic Acid

Oleic Acid

SCHEMBL8993593

CC(=O)Oc1ccccc1C(=O)O.CCCCCCCCC=CCCCCCCCC(=O)O

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGS1PTGS2

The experimentally established mechanism targets of Oleic 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
PTGS1 known ✓ P23219 4/20 0.57
PTGS2 known ✓ P35354 1/20 0.57
ALDH1A1 P00352 5/20 0.57
HSD17B10 Q99714 4/20 0.57
KDM4E B2RXH2 3/20 0.57
BLM P54132 3/20 0.57
TDP1 Q9NUW8 3/20 0.57
HPGD P15428 2/20 0.57
TSHR P16473 2/20 0.57
ESR1 P03372 2/20 0.57
ITGB3 P05106 1/20 0.57
ITGA2B P08514 1/20 0.57
HMGB1 P09429 1/20 0.57
GGT1 P19440 1/20 0.57
NAPRT Q6XQN6 1/20 0.57
RECQL P46063 2/20 0.55
KMT2A Q03164 2/20 0.55
MEN1 O00255 1/20 0.55
PPARG P37231 6/20 0.55
PPARD Q03181 6/20 0.55

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
Oleic Acid SCHEMBL8993588 1.00 ALDH1A1 (0.57) ALDH1A1HSD17B10PTGS1KDM4EBLM
Arachidonic Acid SCHEMBL8816315 0.94 ALDH1A1 (0.58) ALDH1A1HSD17B10PTGS1KDM4EBLM
Behenic Acid SCHEMBL18241553 0.93 PTGS2 (0.67) ALDH1A1HSD17B10PTGS1KDM4EBLM
Dodecanoate SCHEMBL17079885 0.93 PTGS2 (0.67) ALDH1A1HSD17B10PTGS1KDM4EBLM
Palmitic Acid SCHEMBL17079878 0.93 PTGS2 (0.67) ALDH1A1HSD17B10PTGS1KDM4EBLM
Stearic Acid SCHEMBL18587174 0.93 PTGS2 (0.67) ALDH1A1HSD17B10PTGS1KDM4EBLM
Aspirin SCHEMBL8993474 0.93 PTGS2 (0.67) ALDH1A1HSD17B10PTGS1KDM4EBLM
SCHEMBL17369039 0.86 KDM4E (0.75) ALDH1A1HSD17B10PTGS1KDM4EBLM
SCHEMBL7710665 0.86 KDM4E (0.75) ALDH1A1HSD17B10PTGS1KDM4EBLM
SCHEMBL454163 0.86 KDM4E (0.75) ALDH1A1HSD17B10PTGS1KDM4EBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170014432-A1 COMPOSITIONS AND METHODS FOR REDUCING CHRONIC LOW-LEVEL INFLAMMATION SEARS BARRY D (US) 2017-01-19 US disclosed
EP-3116493-A1 COMPOSITIONS AND METHODS FOR REDUCING CHRONIC LOW-LEVEL INFLAMMATION Sears, Barry D. (US) 2017-01-18 EP disclosed
WO-2015138224-A1 COMPOSITIONS AND METHODS FOR REDUCING CHRONIC LOW-LEVEL INFLAMMATION SEARS BARRY D (US) 2015-09-17 WO disclosed
US-5498729-A MIXED ANHYDRIDES DOMB ABRAHAM J (IL) 1996-03-12 US disclosed
EP-0510080-A4 PRODRUG ANHYDRIDES OF ASPRIN, INDOMETHACIN AND IBUPROFEN, THEIR PREPARATION, COMPOSITIONS, AND ANTI-INFLAMMATORY METHOD OF USE 1992-12-02 EP disclosed
EP-0510080-A1 PRODRUG ANHYDRIDES OF ASPRIN, INDOMETHACIN AND IBUPROFEN, THEIR PREPARATION, COMPOSITIONS, AND ANTI-INFLAMMATORY METHOD OF USE NOVA PHARMACEUTICAL CORPORATION (US) 1992-10-28 EP disclosed
WO-1991009831-A1 PRODRUG ANHYDRIDES OF ASPRIN, INDOMETHACIN AND IBUPROFEN, THEIR PREPARATION, COMPOSITIONS, AND ANTI-INFLAMMATORY METHOD OF USE NOVA PHARMACEUTICAL CORPORATION (US) 1991-07-11 WO disclosed