Stearic Acid

Stearic Acid

SCHEMBL3368084

CC(O)CNCC(C)O.CCCCCCCCCCCCCCCCCC(=O)O.O=C1OC(=O)c2ccccc21

nearest known ligand 0.45

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
ASAH1 Q13510 2/20 0.45
ALDH1A1 P00352 3/20 0.44
ACER2 Q5QJU3 1/20 0.44
CDC25A P30304 6/20 0.44
CDC25B P30305 6/20 0.44
CDC25C P30307 5/20 0.44
GPR84 Q9NQS5 7/20 0.42
PPARG P37231 6/20 0.42
PPARD Q03181 6/20 0.42
PPARA Q07869 6/20 0.42
HDAC11 Q96DB2 5/20 0.42
TSHR P16473 4/20 0.42
TLR2 O60603 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
FABP4 P15090 2/20 0.42
PTPN1 P18031 2/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
SLC22A8 Q8TCC7 1/20 0.42
MEN1 O00255 1/20 0.42
ESR1 P03372 1/20 0.42

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
Stearic Acid SCHEMBL11064641 0.87 GPR84 (0.57) ALDH1A1CDC25ACDC25BCDC25CGPR84
Palmitic Acid SCHEMBL28486893 0.82 GPR84 (0.63) ALDH1A1GPR84PPARGPPARDPPARA
Myristic Acid SCHEMBL16667241 0.82 GPR84 (0.63) ALDH1A1GPR84PPARGPPARDPPARA
Decanoic Acid SCHEMBL16667134 0.82 GPR84 (0.63) ALDH1A1GPR84PPARGPPARDPPARA
Stearic Acid SCHEMBL8460661 0.82 GPR84 (0.63) ALDH1A1GPR84PPARGPPARDPPARA
Sebacic Acid SCHEMBL4451750 0.79 TDP1 (0.56) ALDH1A1CDC25ACDC25BHDAC11TSHR
Phthalic Anhydride SCHEMBL9493894 0.79 FFAR4 (0.58) CDC25ACDC25BCDC25CFFAR1FFAR4
Phthalic Anhydride SCHEMBL6437106 0.78 ALOX15 (0.58) ALDH1A1CDC25ACDC25BHDAC11TSHR
Nonanoate SCHEMBL11749939 0.77 CDC25A (0.46) ALDH1A1CDC25ACDC25BCDC25CGPR84
Anthraquinone SCHEMBL6925768 0.76 AKR1B1 (0.59) ALDH1A1GPR84PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2089477-B1 FLAME RETARDANT COMPOSITION COMPRISING DENDRITIC POLYMERS BASF SE (DE) 2012-06-06 EP disclosed
US-20100152376-A1 FLAME RETARDANT COMPOSITION COMPRISING DENDRITIC POLYMERS CIBA CORPORATION (US) 2010-06-17 US disclosed
EP-2089477-A1 FLAME RETARDANT COMPOSITION COMPRISING DENDRITIC POLYMERS Ciba Holding Inc. (CH) 2009-08-19 EP disclosed
WO-2008071575-A1 FLAME RETARDANT COMPOSITION COMPRISING DENDRITIC POLYMERS CIBA HOLDING INC. (CH) 2008-06-19 WO disclosed
EP-1572703-B1 PROCESS FOR THE PREPARATION OF A MELAMINE BASED FLAME RETARDANT AND POLYMER COMPOSITION CIBA SC HOLDING AG (CH) 2007-03-21 EP disclosed
EP-1572703-A2 PROCESS FOR THE PREPARATION OF A MELAMINE BASED FLAME RETARDANT AND POLYMER COMPOSITION Ciba SC Holding AG (CH) 2005-09-14 EP disclosed
WO-2004055029-A2 PROCESS FOR THE PREPARATION OF A MELAMINE BASED FLAME RETARDANT AND POLYMER COMPOSITION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-07-01 WO disclosed