Stearic Acid

Stearic Acid

SCHEMBL1002937

CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].O=S(=O)([O-])[O-].O=S(=O)([O-])[O-].[Cu+2].[Cu+2].[Cu+2]

nearest known ligand 0.75

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 6)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 7/20 0.62
CA1 P00915 1/20 0.60
CES2 O00748 4/20 0.56
CES1 P23141 4/20 0.56
NFKB1 P19838 1/20 0.50
GPR84 Q9NQS5 1/20 0.48

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 SCHEMBL31210069 0.96 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Stearic Acid SCHEMBL31357301 0.96 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Dodecanoate SCHEMBL138674 0.96 CA1 (0.67) FABP3CA1CES2CES1NFKB1
Octanoic Acid SCHEMBL3283210 0.96 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Dodecanoate SCHEMBL8140299 0.96 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Stearic Acid SCHEMBL7042513 0.96 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Stearic Acid SCHEMBL10488816 0.96 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Stearic Acid SCHEMBL18197505 0.96 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Palmitic Acid SCHEMBL8511539 0.96 CA1 (0.67) FABP3CA1CES2CES1NFKB1
Dodecanoate SCHEMBL28961972 0.96 FABP3 (0.62) FABP3CA1CES2CES1NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2305380-A1 Methods for generating and recycling metal halide catalyst compositions for aromatic ring halogenation SABIC Innovative Plastics IP B.V. (NL) 2011-04-06 EP claimed
US-7863209-B2 Methods for recycling catalyst compositions for aromatic ring halogenation SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2011-01-04 US claimed
US-7763760-B2 Catalyst composition and method for halogenating aromatic compounds SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2010-07-27 US claimed
JP-2008503462-A 2008-02-07 JP claimed
JP-2008503461-A 2008-02-07 JP claimed
EP-1778398-A2 CATALYST COMPOSITION AND METHOD FOR HALOGENATING AROMATIC COMPOUNDS GENERAL ELECTRIC COMPANY (US) 2007-05-02 EP claimed
EP-1758679-A2 METHODS FOR GENERATING AND RECYCLING METAL HALIDE CATALYST COMPOSITIONS FOR AROMATIC RING HALOGENATION GENERAL ELECTRIC COMPANY (US) 2007-03-07 EP claimed
WO-2006009661-A2 CATALYST COMPOSITION AND METHOD FOR HALOGENATING AROMATIC COMPOUNDS GENERAL ELECTRIC COMPANY (US) 2006-01-26 WO claimed
WO-2006009662-A2 METHODS FOR GENERATING AND RECYCLING METAL HALIDE CATALYST COMPOSITIONS FOR AROMATIC RING ALOGENATION GENERAL ELECTRIC COMPANY (US) 2006-01-26 WO claimed
US-20050283035-A1 Catalyst compostion and method for halogenating aromatic compounds GENERAL ELECTRIC COMPANY 2005-12-22 US claimed
US-20050283034-A1 Methods for recycling catalyst compositions for aromatic ring halogenation GENERAL ELECTRIC COMPANY 2005-12-22 US claimed
EP-2305380-A1 Methods for generating and recycling metal halide catalyst compositions for aromatic ring halogenation SABIC Innovative Plastics IP B.V. (NL) 2011-04-06 EP disclosed
US-7863209-B2 Methods for recycling catalyst compositions for aromatic ring halogenation SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2011-01-04 US disclosed
US-7763760-B2 Catalyst composition and method for halogenating aromatic compounds SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2010-07-27 US disclosed
EP-1778398-A2 CATALYST COMPOSITION AND METHOD FOR HALOGENATING AROMATIC COMPOUNDS GENERAL ELECTRIC COMPANY (US) 2007-05-02 EP disclosed
EP-1758679-A2 METHODS FOR GENERATING AND RECYCLING METAL HALIDE CATALYST COMPOSITIONS FOR AROMATIC RING HALOGENATION GENERAL ELECTRIC COMPANY (US) 2007-03-07 EP disclosed
WO-2006009662-A2 METHODS FOR GENERATING AND RECYCLING METAL HALIDE CATALYST COMPOSITIONS FOR AROMATIC RING ALOGENATION GENERAL ELECTRIC COMPANY (US) 2006-01-26 WO disclosed
WO-2006009661-A2 CATALYST COMPOSITION AND METHOD FOR HALOGENATING AROMATIC COMPOUNDS GENERAL ELECTRIC COMPANY (US) 2006-01-26 WO disclosed
US-20050283035-A1 Catalyst compostion and method for halogenating aromatic compounds GENERAL ELECTRIC COMPANY 2005-12-22 US disclosed
US-20050283034-A1 Methods for recycling catalyst compositions for aromatic ring halogenation GENERAL ELECTRIC COMPANY 2005-12-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050283034-A1 Methods for recycling catalyst compositions for aromatic ring halogenation PRKACG, HCN4, CLIC4 FABP3 4440/4885CA1 1141/4885CES2 2366/4885
US-20050283035-A1 Catalyst compostion and method for halogenating aromatic compounds AOC2, TYR, PRKX FABP3 4768/4885CA1 198/4885CES2 665/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.