Stearic Acid

Stearic Acid

SCHEMBL28628353

CCCCC(C)(C)N.CCCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.65

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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 0.65
PPARG P37231 7/20 0.65
PPARD Q03181 7/20 0.65
PPARA Q07869 7/20 0.65
HDAC11 Q96DB2 5/20 0.65
TSHR P16473 4/20 0.65
PTPN1 P18031 3/20 0.65
FABP4 P15090 3/20 0.65
ALDH1A1 P00352 2/20 0.65
TLR2 O60603 2/20 0.65
TDP1 Q9NUW8 2/20 0.65
KMT2A Q03164 2/20 0.65
ALOX15 P16050 2/20 0.65
HSD17B10 Q99714 2/20 0.65
SLC22A6 Q4U2R8 1/20 0.65
SLC22A8 Q8TCC7 1/20 0.65
MEN1 O00255 1/20 0.65
ESR1 P03372 1/20 0.65
PDE4A P27815 1/20 0.65
PDE3A Q14432 1/20 0.65

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
Heptanoate SCHEMBL3412856 0.96 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL3416660 0.96 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL3411942 0.92 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Valeric Acid SCHEMBL7547365 0.92 GPR84 (0.59) GPR84PPARGPPARDPPARAHDAC11
Valeric Acid SCHEMBL3416634 0.92 GPR84 (0.59) GPR84PPARGPPARDPPARAHDAC11
Valeric Acid SCHEMBL3410666 0.90 AKR1B1 (0.58) GPR84PPARGPPARDPPARAHDAC11
Hexanoate SCHEMBL3410844 0.90 AKR1B1 (0.64) GPR84PPARGPPARDPPARAHDAC11
Behenic Acid SCHEMBL19639124 0.89 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL19640926 0.89 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL9421725 0.88 GPR84 (0.71) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110776684-B Double-layer rotational molding product manufactured based on mucosa temperature difference and preparation method thereof 浙江瑞堂塑料科技股份有限公司 2022-03-08 CN claimed
CN-113308037-B Large-particle rotational molding composite material with different color surface effects and preparation method thereof 浙江瑞堂塑料科技股份有限公司 2022-06-17 CN disclosed
CN-113308037-A Large-particle rotational molding composite material with different color surface effects and preparation method thereof 浙江瑞堂塑料科技股份有限公司 2021-08-27 CN disclosed