2-Ethylhexanoic Acid

2-Ethylhexanoic Acid

SCHEMBL22069985

CCC(C)(C)OOC(C)(C)CC.CCCCC(CC)C(=O)O

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.71
MAPK1 P28482 2/20 0.71
CA1 P00915 4/20 0.50
SLC1A2 P43004 3/20 0.47
SLC1A1 P43005 3/20 0.47
SLC1A3 P43003 2/20 0.47
GRIK1 P39086 2/20 0.42
GRIK2 Q13002 2/20 0.42
CHRM1 P11229 1/20 0.42
AKR1A1 P14550 1/20 0.42
CHRM3 P20309 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
ADRA1A P35348 1/20 0.42
HRH1 P35367 1/20 0.42
DRD3 P35462 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
TDP1 Q9NUW8 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
2-Ethylhexanoic Acid SCHEMBL29024678 0.89 CA2 (0.71) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL28402120 0.88 CA2 (0.69) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL4428624 0.86 CA2 (0.67) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL1208050 0.85 CA2 (0.77) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL5698808 0.85 CA2 (0.77) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL28001398 0.85 CA2 (0.83) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL3658908 0.85 CA2 (0.83) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL9161259 0.85 CA2 (0.83) CA2MAPK1CA1SLC1A2SLC1A1
SCHEMBL1883197 0.85 CA2 (0.50) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL8375903 0.84 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3666754-B1 FULLY CONTINUOUS FLOW PRODUCTION PROCESS FOR DIRECTLY PREPARING ORGANIC PEROXIDE FROM ALCOHOL OR ALKANE SHANGHAI HYBRID CHEM TECH (CN) 2023-03-29 EP claimed
WO-2022021770-A1 MULTIFUNCTIONAL PACKAGING ADHESIVE FILM AND PREPARATION METHOD THEREFOR 苏州赛伍应用技术股份有限公司 2022-02-03 WO claimed
US-10919849-B2 Online continuous flow process for the preparation of organic peroxides direct from alcohols or alkanes SHANGHAI HYBRID-CHEM TECHNOLOGIES (CN) 2021-02-16 US claimed
US-20200199068-A1 ONLINE CONTINUOUS FLOW PROCESS FOR THE PREPARATION OF ORGANIC PEROXIDES DIRECT FROM ALCOHOLS OR ALKANES SHANGHAI HYBRID-CHEM TECHNOLOGIES (CN) 2020-06-25 US claimed
EP-3666754-A1 ONLINE FULLY CONTINUOUS FLOW PRODUCTION PROCESS FOR DIRECTLY PREPARING ORGANIC PEROXIDE FROM ALCOHOL OR ALKANE Shanghai Hybrid-Chem Technologies (CN) 2020-06-17 EP claimed
CN-118620208-A Composition for preparing base curing resin, application of composition, base curing resin and preparation method and application of base curing resin 中国石油化工股份有限公司 2024-09-10 CN disclosed
CN-118620207-A Composition for preparing base curing resin, application of composition, base curing resin and preparation method and application of base curing resin 中国石油化工股份有限公司 2024-09-10 CN disclosed
CN-117511387-B Preparation method of printing gloss oil containing poly (urethane-acrylate) 江苏众立生包装科技有限公司 2024-04-30 CN disclosed
CN-117843880-A High-adhesion polyester material capable of being melt-processed and preparation method thereof 广东莱尔新材料科技股份有限公司 2024-04-09 CN disclosed
CN-117806120-A Composition, transfer film, method for producing laminate, cured film, and device 富士胶片株式会社 2024-04-02 CN disclosed
CN-117511387-A Preparation method of printing gloss oil containing poly (urethane-acrylate) 江苏众立生包装科技有限公司 2024-02-06 CN disclosed
CN-117264132-A Polymer polyol and process for producing the same 锦湖石油化学株式会社 2023-12-22 CN disclosed
CN-109776358-B Polyalkenyl aryl isocyanate and preparation method and application thereof 万华化学集团股份有限公司 2021-05-14 CN disclosed
US-10919849-B2 Online continuous flow process for the preparation of organic peroxides direct from alcohols or alkanes SHANGHAI HYBRID-CHEM TECHNOLOGIES (CN) 2021-02-16 US disclosed
CN-112239460-A Aromatic bismaleimide compound, method for producing same, and thermosetting cyclic imide resin composition containing same 信越化学工业株式会社 2021-01-19 CN disclosed
EP-3694946-A1 UV-CURING HOT-MELT ADHESIVE RESISTANT TO PLASTICIZER MIGRATION, FOR GRAPHIC FILMS AND LABELS OF SOFT PVC BASF SE (DE) 2020-08-19 EP disclosed
US-20200199068-A1 ONLINE CONTINUOUS FLOW PROCESS FOR THE PREPARATION OF ORGANIC PEROXIDES DIRECT FROM ALCOHOLS OR ALKANES SHANGHAI HYBRID-CHEM TECHNOLOGIES (CN) 2020-06-25 US disclosed
EP-3666754-A1 ONLINE FULLY CONTINUOUS FLOW PRODUCTION PROCESS FOR DIRECTLY PREPARING ORGANIC PEROXIDE FROM ALCOHOL OR ALKANE Shanghai Hybrid-Chem Technologies (CN) 2020-06-17 EP disclosed
CN-108602335-B Stretched film of thermoplastic resin laminate 三菱瓦斯化学株式会社 2020-05-08 CN disclosed
CN-110972480-A Styrene-acrylate copolymer 株式会社大阪曹达 2020-04-07 CN 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-10919849-B2 Online continuous flow process for the preparation of organic peroxides direct from alcohols or alkanes ADH1A, ADH1C, AOX1 CA2 2577/4885MAPK1 1470/4885CA1 2265/4885
US-20200199068-A1 ONLINE CONTINUOUS FLOW PROCESS FOR THE PREPARATION OF ORGANIC PEROXIDES DIRECT FROM ALCOHOLS OR ALKANES ADH1A, ADH1C, AOX1 CA2 2577/4885MAPK1 1470/4885CA1 2265/4885

“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.