Octanoic Acid

Octanoic Acid

SCHEMBL22720164

CCCC(=O)OC(=O)C(O)CO.CCCCCCCC(=O)O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.52
PPARG P37231 7/20 0.52
PPARD Q03181 7/20 0.52
PPARA Q07869 7/20 0.52
HDAC11 Q96DB2 5/20 0.52
TSHR P16473 4/20 0.52
PTPN1 P18031 3/20 0.52
ALDH1A1 P00352 2/20 0.52
TLR2 O60603 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
FABP4 P15090 2/20 0.52
FFAR1 O14842 2/20 0.52
FFAR4 Q5NUL3 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
SLC22A6 Q4U2R8 1/20 0.52
SLC22A8 Q8TCC7 1/20 0.52
ESR1 P03372 1/20 0.52
ALOX15 P16050 1/20 0.52
PDE4A P27815 1/20 0.52

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
Octanoic Acid SCHEMBL23668206 0.95 MEN1 (0.54) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL20183301 0.95 MEN1 (0.54) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL6366300 0.95 MEN1 (0.54) GPR84PPARGPPARDPPARAHDAC11
Behenic Acid SCHEMBL626540 0.95 MEN1 (0.54) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL7999492 0.95 MEN1 (0.54) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL8003147 0.91 GPR84 (0.59) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL10598986 0.91 GPR84 (0.59) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL16041 0.89 LMNA (0.60) ALDH1A1MEN1KMT2AKDM4EDUSP3
SCHEMBL21685975 0.89 LMNA (0.60) ALDH1A1MEN1KMT2AKDM4EDUSP3
SCHEMBL2119135 0.89 LMNA (0.60) ALDH1A1MEN1KMT2AKDM4EDUSP3

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
WO-2020238406-A1 FEED COMPOSITION AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 山东省新奥农牧发展有限公司 2020-12-03 WO disclosed