Dodecanoate

Dodecanoate

SCHEMBL2953202

CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCC[P+](CCCCCC)(CCCCCC)CCCCCC

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 7/20 0.60
NFKB1 P19838 1/20 0.58
CA1 P00915 1/20 0.58
GPR84 Q9NQS5 1/20 0.56
DNM1 Q05193 2/20 0.56
CES2 O00748 3/20 0.54
CES1 P23141 3/20 0.54

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
Decanoic Acid SCHEMBL194214 1.00 FABP3 (0.60) FABP3NFKB1CA1GPR84DNM1
Palmitic Acid SCHEMBL28907711 1.00 FABP3 (0.60) FABP3NFKB1CA1GPR84DNM1
Decanoic Acid SCHEMBL6544079 1.00 FABP3 (0.60) FABP3NFKB1CA1GPR84DNM1
Hexanoate SCHEMBL11176554 1.00 FABP3 (0.60) FABP3NFKB1CA1GPR84DNM1
Myristic Acid SCHEMBL20489379 1.00 FABP3 (0.60) FABP3NFKB1CA1GPR84DNM1
Hexanoate SCHEMBL17839050 1.00 FABP3 (0.60) FABP3NFKB1CA1GPR84DNM1
Octanoic Acid SCHEMBL11573973 1.00 FABP3 (0.60) FABP3NFKB1CA1GPR84DNM1
Octanoic Acid SCHEMBL17453697 1.00 FABP3 (0.60) FABP3NFKB1CA1GPR84DNM1
Octanoic Acid SCHEMBL16007959 0.98 DNM1 (0.60) FABP3NFKB1CA1GPR84DNM1
Hexanoate SCHEMBL29936528 0.98 FABP3 (0.58) FABP3NFKB1CA1GPR84DNM1

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-108949889-B Method for preparing androstenedione through phytosterol biotransformation in quaternary phosphonium salt ionic liquid/water two-phase system 浙江大学 2021-02-05 CN disclosed
EP-3233872-B1 QUATERNARY CARBOXYLATE COMPOSITIONS FOR EXTRACTING C1 TO C4 CARBOXYLIC ACIDS FROM AQUEOUS STREAMS EASTMAN CHEM CO (US) 2019-10-30 EP disclosed
US-9573078-B2 Quaternary carboxylate compositions for extracting C1 to C4 carboxylic acids from aqueous streams EASTMAN CHEMICAL COMPANY (US) 2017-02-21 US disclosed
US-20160175737-A1 Quaternary Carboxylate Compositions for Extracting C1 to C4 Carboxylic Acids from Aqueous Streams EASTMAN CHEMICAL COMPANY (US) 2016-06-23 US disclosed
US-7759401-B2 Nanoporous and microporous solvogels and nanolatexes by microemulsion polymerization EASTERN MICHIGAN UNIVERSITY (US) 2010-07-20 US disclosed
US-20090176915-A1 NANOPOROUS AND MICROPOROUS SOLVOGELS AND NONOLATEXES BY MICROEMULSION POLYMERIZATION EASTERN MICHIGAN UNIVERSITY 2009-07-09 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 (1 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-20160175737-A1 Quaternary Carboxylate Compositions for Extracting C1 to C4 Carboxylic Acids from Aqueous Streams SLC16A3, CA4, SLC16A1 FABP3 534/4885NFKB1 1523/4885CA1 27/4885

“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.