Octanoic Acid

Octanoic Acid

SCHEMBL1031982

CCCCCCCC(=O)O.NCC(=O)O

nearest known ligand 0.81

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Octanoic 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
PDE4A known ✓ P27815 1/20 0.81
PDE3A known ✓ Q14432 1/20 0.81
GPR84 Q9NQS5 7/20 0.81
PPARG P37231 7/20 0.81
PPARD Q03181 7/20 0.81
PPARA Q07869 7/20 0.81
HDAC11 Q96DB2 5/20 0.81
TSHR P16473 4/20 0.81
PTPN1 P18031 3/20 0.81
FABP4 P15090 3/20 0.81
ALDH1A1 P00352 2/20 0.81
TLR2 O60603 2/20 0.81
TDP1 Q9NUW8 2/20 0.81
KMT2A Q03164 2/20 0.81
ALOX15 P16050 2/20 0.81
HSD17B10 Q99714 2/20 0.81
SLC22A6 Q4U2R8 1/20 0.81
SLC22A8 Q8TCC7 1/20 0.81
MEN1 O00255 1/20 0.81
ESR1 P03372 1/20 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
Palmitic Acid SCHEMBL28497727 1.00 GPR84 (0.81) GPR84PPARGPPARDPPARAHDAC11
Myristic Acid SCHEMBL7533929 1.00 GPR84 (0.81) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL2712826 1.00 GPR84 (0.81) GPR84PPARGPPARDPPARAHDAC11
Decanoic Acid SCHEMBL31288181 1.00 GPR84 (0.81) GPR84PPARGPPARDPPARAHDAC11
Dodecanoate SCHEMBL28507105 1.00 GPR84 (0.81) GPR84PPARGPPARDPPARAHDAC11
Hexacosanoic Acid SCHEMBL8585366 1.00 GPR84 (0.81) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL29648512 0.98 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL873217 0.98 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL5078569 0.96 GPR84 (0.74) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL9164233 0.95 GPR84 (0.81) GPR84PPARGPPARDPPARAHDAC11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11643595-B2 Wavelength conversion member, light-emitting device, and image display device NICHIA CORPORATION (JP) 2023-05-09 US disclosed
US-20220403231-A1 WAVELENGTH CONVERSION MEMBER, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY DEVICE NICHIA CORPORATION (JP) 2022-12-22 US disclosed
CN-110123695-B Cell energy restoration composition 惠州学院 2021-04-27 CN disclosed
US-8287846-B2 Cosmetic or dermatological preparations comprising N-acetylcysteine ZAMBON S.P.A. (IT) 2012-10-16 US disclosed
EP-2046277-B1 COSMETIC OR DERMATOLOGICAL PREPARATIONS COMPRISING N-ACETYLCYSTEINE ZAMBON SPA (IT) 2011-01-19 EP disclosed
US-20100021399-A1 COSMETIC OR DERMATOLOGICAL PREPARATIONS COMPRISING N-ACETYLCYSTEINE ZAMBON S.P.A (IT) 2010-01-28 US disclosed
EP-2046277-A1 COSMETIC OR DERMATOLOGICAL PREPARATIONS COMPRISING N-ACETYLCYSTEINE ZAMBON S.p.A. (IT) 2009-04-15 EP disclosed
WO-2008012220-A1 COSMETIC OR DERMATOLOGICAL PREPARATIONS COMPRISING N-ACETYLCYSTEINE ZAMBON S.P.A. (IT) 2008-01-31 WO disclosed