Linoleic Acid

Linoleic Acid

SCHEMBL30065313

CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].[Bi+3]

nearest known ligand 0.84

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

HRH2

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
FABP3 P05413 8/20 0.84
ALDH1A1 P00352 5/20 0.81
PPARG P37231 5/20 0.81
F7 P08709 4/20 0.81
F3 P13726 4/20 0.81
PPARD Q03181 4/20 0.81
PPARA Q07869 4/20 0.81
FFAR1 O14842 3/20 0.81
PTGS1 P23219 2/20 0.81
KDM4E B2RXH2 2/20 0.81
LMNA P02545 2/20 0.81
CYP3A4 P08684 2/20 0.81
CYP19A1 P11511 2/20 0.81
FABP4 P15090 2/20 0.81
HPGD P15428 2/20 0.81
ALOX15 P16050 2/20 0.81
AKR1C3 P42330 2/20 0.81
NR4A2 P43354 2/20 0.81
HSD17B10 Q99714 2/20 0.81
TDP1 Q9NUW8 2/20 0.81

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 SCHEMBL996489 0.97 FABP3 (0.84) FABP3ALDH1A1PPARGF7F3
Linoleic Acid SCHEMBL10907349 0.97 FABP3 (0.88) FABP3ALDH1A1PPARGF7F3
Linoleic Acid SCHEMBL6193533 0.97 FABP3 (0.84) FABP3ALDH1A1PPARGF7F3
Linoleic Acid SCHEMBL2481912 0.94 FABP3 (0.96) FABP3ALDH1A1PPARGF7F3
Oleic Acid SCHEMBL25397911 0.92 FABP3 (0.86) FABP3PPARGF7F3PPARD
Oleic Acid SCHEMBL2705978 0.92 FABP3 (0.86) FABP3PPARGF7F3PPARD
Oleic Acid SCHEMBL1965575 0.92 FABP3 (0.83) FABP3PPARGF7F3PPARD
Oleic Acid SCHEMBL961490 0.92 FABP3 (0.83) FABP3PPARGF7F3PPARD
Oleic Acid SCHEMBL4585827 0.92 FABP3 (0.83) FABP3PPARGF7F3PPARD
Oleic Acid SCHEMBL11172313 0.92 FABP3 (0.86) FABP3PPARGF7F3PPARD

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
CN-110382575-B Active energy ray-curable resin composition and coating agent 三菱化学株式会社 2022-11-22 CN disclosed