Linoleic Acid

Linoleic Acid

SCHEMBL2693995

CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.O=C(O)c1ccccc1

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CACNA1CCACNA1DCACNA1FCACNA1SDPP4HTR1BHTR1D

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 0.74
PPARD Q03181 6/20 0.74
PPARA Q07869 6/20 0.74
ALDH1A1 P00352 5/20 0.74
F7 P08709 5/20 0.74
F3 P13726 5/20 0.74
FABP4 P15090 4/20 0.74
HSD17B10 Q99714 4/20 0.74
FFAR1 O14842 3/20 0.74
PTGS1 P23219 3/20 0.74
LMNA P02545 3/20 0.74
CYP19A1 P11511 3/20 0.74
ALOX15 P16050 3/20 0.74
NR4A2 P43354 3/20 0.74
KDM4E B2RXH2 2/20 0.74
CYP3A4 P08684 2/20 0.74
HPGD P15428 2/20 0.74
AKR1C3 P42330 2/20 0.74
TDP1 Q9NUW8 2/20 0.74
DUSP3 P51452 2/20 0.74

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 SCHEMBL11169918 0.97 PPARG (0.70) PPARGPPARDPPARAALDH1A1F7
Oleic Acid SCHEMBL11169925 0.97 PPARG (0.70) PPARGPPARDPPARAALDH1A1F7
Oleic Acid SCHEMBL28412739 0.96 PPARG (0.68) PPARGPPARDPPARAALDH1A1F7
Oleic Acid SCHEMBL3527457 0.96 PPARG (0.68) PPARGPPARDPPARAALDH1A1F7
Oleic Acid SCHEMBL3527464 0.96 PPARG (0.68) PPARGPPARDPPARAALDH1A1F7
Oleic Acid SCHEMBL11175477 0.96 PPARG (0.68) PPARGPPARDPPARAALDH1A1F7
Oleic Acid SCHEMBL11175491 0.96 PPARG (0.68) PPARGPPARDPPARAALDH1A1F7
Oleic Acid SCHEMBL5270864 0.96 PPARG (0.68) PPARGPPARDPPARAALDH1A1F7
Oleic Acid SCHEMBL5270878 0.96 PPARG (0.68) PPARGPPARDPPARAALDH1A1F7
Terephthalic Acid SCHEMBL28326625 0.91 PPARG (0.74) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9206264-B2 Method for producing modified conjugated diene based (co)polymer, modified conjugated diene based (co)polymer, and rubber composition JSR CORPORATION (JP) 2015-12-08 US disclosed
EP-2130842-B1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER, AND RUBBER COMPOSITION JSR CORP (JP) 2013-05-15 EP disclosed
US-8178626-B2 Method for producing modified conjugated diene based (co)polymer, modified conjugated diene based (co)polymer, and rubber composition JSR CORPORATION (JP) 2012-05-15 US disclosed
US-20120108737-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE BASED (CO)POLYMER, MODIFIED CONJUGATED DIENE BASED (CO)POLYMER, AND RUBBER COMPOSITION JSR CORPORATION (JP) 2012-05-03 US disclosed
US-20100152369-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE BASED (CO)POLYMER, MODIFIED CONJUGATED DIENE BASED (CO)POLYMER, AND RUBBER COMPOSITION JSR CORPORATION (JP) 2010-06-17 US disclosed
EP-2130842-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER, AND RUBBER COMPOSITION JSR Corporation (JP) 2009-12-09 EP disclosed