2-Ethylhexanoic Acid

2-Ethylhexanoic Acid

SCHEMBL546923

CCCCC(CC)C(=O)O.[SnH4]

nearest known ligand 0.95

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.95
MAPK1 P28482 2/20 0.95
CA1 P00915 4/20 0.61
SLC1A2 P43004 3/20 0.59
SLC1A1 P43005 3/20 0.59
SLC1A3 P43003 2/20 0.59
CHRM1 P11229 1/20 0.54
AKR1A1 P14550 1/20 0.54
CHRM3 P20309 1/20 0.54
HTR2A P28223 1/20 0.54
HTR2C P28335 1/20 0.54
ADRA1A P35348 1/20 0.54
HRH1 P35367 1/20 0.54
DRD3 P35462 1/20 0.54
SLC6A3 Q01959 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC2 Q92769 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
GRIK1 P39086 2/20 0.52
GRIK2 Q13002 2/20 0.52

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 SCHEMBL6741711 0.98 CA2 (0.91) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL8387406 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL282014 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL8375903 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL25800 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL301319 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL5512393 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL6121661 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL5695779 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL25318625 0.95 CA2 (0.95) 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 190 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2498835-B1 BIODEGRADABLE THERMOPLASTIC ELASTOMERS UNIV NANYANG TECH (SG) 2017-05-24 EP claimed
US-20170066913-A1 Process to Make a Composition Comprising a Monovinylaromatic Polymer and a Polymer Made From Renewable Resources TOTAL RES & TECHNOLOGY FELUY (BE) 2017-03-09 US claimed
US-9091669-B2 Gas sensor and method for producing the same EBERGHARD KARLS UNIVERSITAT TUBINGEN (DE) 2015-07-28 US claimed
EP-2593779-B1 GAS SENSOR AND METHOD FOR PRODUCING THE SAME EBERHARD KARLS UNIVERSITÄT TÜBINGEN (DE) 2014-05-21 EP claimed
US-8716410-B2 Biodegradable thermoplastic elastomers NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2014-05-06 US claimed
US-8512604-B2 Photochromic coating exhibiting improved performance and reduced yellowness ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2013-08-20 US claimed
US-20130111974-A1 GAS SENSOR AND METHOD FOR PRODUCING THE SAME UNIVERSITÄT BREMEN (DE) 2013-05-09 US claimed
US-20120283391-A1 BIODEGRADABLE THERMOPLASTIC ELASTOMERS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2012-11-08 US claimed
EP-2307462-B1 PROCESS TO MAKE A COMPOSITION COMPRISING A MONOVINYLAROMATIC POLYMER AND A POLYMER MADE FROM RENEWABLE RESOURCES TOTAL RES & TECHNOLOGY FELUY (BE) 2012-10-31 EP claimed
EP-2498835-A1 BIODEGRADABLE THERMOPLASTIC ELASTOMERS Nanyang Technological University (SG) 2012-09-19 EP claimed
WO-2010010139-A1 PROCESS TO MAKE A COMPOSITION COMPRISING A MONOVINYLAROMATIC POLYMER AND A POLYMER MADE FROM RENEWABLE RESOURCES TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2010-01-28 WO claimed
EP-2147934-A1 Process to make a composition comprising a monovinylaromatic polymer and a polymer made from renewable resources TOTAL PETROCHEMICALS FRANCE (FR) 2010-01-27 EP claimed
US-20090315199-A1 PHOTOCHROMIC COATING EXHIBITING IMPROVED PERFORMANCE ESSILOR INTERNATIONAL (FR) 2009-12-24 US claimed
WO-2009155425-A1 PHOTOCHROMIC COATING EXHIBITING IMPROVED PERFORMANCE AND REDUCED YELLOWNESS ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2009-12-23 WO claimed
US-20090292036-A1 TRIMER AND ALLOPHANATE MODIFIED ISOCYANATES, A PROCESS FOR THEIR PRODUCTION, FOAMS COMPRISING THESE MODIFIED ISOCYANATES, AND A PROCESS FOR THE PRODUCTION OF THESE FOAMS BAYER MATERIALSCIENCE LLC (US) 2009-11-26 US claimed
WO-2009081169-A2 BIODEGRADABLE CONTRAST AGENTS IOPHARMA TECHNOLOGIES AB (SE) 2009-07-02 WO claimed
US-20080227878-A1 Trimer and allophanate modified isocyanates, a process for their production, foams comprising these modified isocyanates, and a process for the production of these foams BAYER MATERIALSCIENCE LLC 2008-09-18 US claimed
EP-1970393-A1 Trimer and allophanate modified isocyanates, a process for their production, foams comprising these modified isocyanates, and a process for the production of these foams Bayer MaterialScience LLC (US) 2008-09-17 EP claimed
US-5955609-A Trimer catalyst system for aliphatic and aromatic isocyanates BAYER CORPORATION (US) 1999-09-21 US claimed
US-4153586-A WATER SOLUBILITY PPG INDUSTRIES, INC. (US) 1979-05-08 US claimed