Stearic Acid

Stearic Acid

SCHEMBL28986985

CCCCCCCCCCCCCCCCCC(=O)O.CCN(CC)CC.[MgH2]

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

rplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Stearic 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
GPR84 Q9NQS5 7/20 0.74
PPARG P37231 7/20 0.74
PPARD Q03181 7/20 0.74
PPARA Q07869 7/20 0.74
HDAC11 Q96DB2 5/20 0.74
TSHR P16473 4/20 0.74
PTPN1 P18031 3/20 0.74
FABP4 P15090 3/20 0.74
ALDH1A1 P00352 2/20 0.74
TLR2 O60603 2/20 0.74
TDP1 Q9NUW8 2/20 0.74
KMT2A Q03164 2/20 0.74
ALOX15 P16050 2/20 0.74
HSD17B10 Q99714 2/20 0.74
SLC22A6 Q4U2R8 1/20 0.74
SLC22A8 Q8TCC7 1/20 0.74
MEN1 O00255 1/20 0.74
ESR1 P03372 1/20 0.74
PDE4A P27815 1/20 0.74
PDE3A Q14432 1/20 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
Nonanoate SCHEMBL5874090 0.98 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL557594 0.98 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Dodecanoate SCHEMBL8469515 0.98 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL3414554 0.98 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Undecanoate SCHEMBL21145218 0.98 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL3412884 0.98 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Heptanoate SCHEMBL3410001 0.98 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Decanoic Acid SCHEMBL5875269 0.98 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL28159534 0.96 GPR84 (0.74) GPR84PPARGPPARDPPARAHDAC11
Hexanoate SCHEMBL3411666 0.96 AKR1B1 (0.76) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114073694-B Butylphthalide preparation and preparation method thereof 北京科莱博医药开发有限责任公司 2024-03-12 CN disclosed
CN-117229335-A Bairimhydroquinone glycoside compound and preparation method and application thereof 云南民族大学 2023-12-15 CN disclosed
CN-117024504-A Glucuronic acid triterpenoid saponin and application thereof 云南民族大学 2023-11-10 CN disclosed
CN-114874174-B Chromans with anti-hepatitis B virus and coronavirus effects 云南民族大学 2023-09-22 CN disclosed
CN-114573591-B Substituted pyrrolopyrimidine compound and application thereof 成都施贝康生物医药科技有限公司 2023-04-25 CN disclosed
WO-2022193969-A1 USE OF PHYTOL IN PREPARATION OF ANTI-MIGRAINE DRUG 云南民族大学 2022-09-22 WO disclosed