Stearic Acid

Stearic Acid

SCHEMBL14964617

CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)OC(C)(C)C.CN(C)CCO

nearest known ligand 0.50

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
▸ DNM1 Q05193 2/20 0.50
▸ GPR84 Q9NQS5 7/20 0.47
▸ PPARG P37231 7/20 0.47
▸ PPARD Q03181 7/20 0.47
▸ PPARA Q07869 7/20 0.47
▸ HDAC11 Q96DB2 5/20 0.47
▸ TSHR P16473 4/20 0.47
▸ PTPN1 P18031 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ TLR2 O60603 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ FABP4 P15090 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ SLC22A6 Q4U2R8 1/20 0.47
▸ SLC22A8 Q8TCC7 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ ESR1 P03372 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ PDE4A P27815 1/20 0.47
▸ PDE3A Q14432 1/20 0.47

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 SCHEMBL1131494 0.85 GPR84 (0.65) DNM1GPR84PPARGPPARDPPARA
Decanoic Acid SCHEMBL1131716 0.85 GPR84 (0.65) DNM1GPR84PPARGPPARDPPARA
Palmitic Acid SCHEMBL11331214 0.85 GPR84 (0.65) DNM1GPR84PPARGPPARDPPARA
Stearic Acid SCHEMBL14718084 0.85 GPR84 (0.65) DNM1GPR84PPARGPPARDPPARA
Undecanoate SCHEMBL1132344 0.85 GPR84 (0.65) DNM1GPR84PPARGPPARDPPARA
Undecanoate SCHEMBL5552240 0.85 GPR84 (0.65) DNM1GPR84PPARGPPARDPPARA
Heptanoate SCHEMBL1131028 0.85 GPR84 (0.65) DNM1GPR84PPARGPPARDPPARA
Dodecanoate SCHEMBL1131707 0.85 GPR84 (0.65) DNM1GPR84PPARGPPARDPPARA
Nonanoate SCHEMBL1131264 0.85 GPR84 (0.65) DNM1GPR84PPARGPPARDPPARA
Hexanoate SCHEMBL1131199 0.83 AKR1B1 (0.64) DNM1GPR84PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2780302-A1 BLASTING COMPOSITIONS Dyno Nobel Asia Pacific Pty Limited (AU) 2014-09-24 — — EP disclosed
WO-2013071363-A1 BLASTING COMPOSITIONS DYNO NOBEL ASIA PACIFIC PTY LTD (AU) 2013-05-23 — — WO disclosed
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