2-Ethylhexanoic Acid

2-Ethylhexanoic Acid

SCHEMBL2493054

CCCC1OOC1(CC)C(=O)OC(C)(C)C.CCCCC(CC)C(=O)O

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.46
MAPK1 P28482 1/20 0.46
CA1 P00915 4/20 0.34
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31

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
SCHEMBL41682 0.85 ALDH1A1 (0.31) KMT2A
SCHEMBL10753120 0.81 SPHK1 (0.31)
SCHEMBL29647691 0.80 CA2 (0.42) CA2MAPK1CA1GAA
SCHEMBL499958 0.74
SCHEMBL6576236 0.74 CA2 (0.36) CA2MAPK1CA1
SCHEMBL5855273 0.73
2-Ethylhexanoic Acid SCHEMBL29638055 0.69 CA2 (0.95) CA2MAPK1CA1MEN1KMT2A
2-Ethylhexanoic Acid SCHEMBL29286897 0.68 CA2 (0.77) CA2MAPK1CA1MEN1GAA
2-Ethylhexanoic Acid SCHEMBL1208050 0.68 CA2 (0.77) CA2MAPK1CA1MEN1GAA
2-Ethylhexanoic Acid SCHEMBL27259506 0.68 CA2 (0.77) CA2MAPK1CA1MEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240076415-A1 MECHANICALLY INTERLOCKED MOLECULES-BASED MATERIALS FOR 3-D PRINTING TRUSTEES OF DARTMOUTH COLLEGE (US) 2024-03-07 US disclosed
US-20240002685-A1 THREE-DIMENSIONAL PRINTING WITH SUPRAMOLECULAR TEMPLATED HYDROGELS TRUSTEES OF DARTMOUTH COLLEGE (US) 2024-01-04 US disclosed
US-11845812-B2 Mechanically interlocked molecules-based materials for 3-D printing TRUSTEES OF DARTMOUTH COLLEGE (US) 2023-12-19 US disclosed
US-11814527-B2 Three-dimensional printing with supramolecular templated hydrogels TRUSTEES OF DARTMOUTH COLLEGE (US) 2023-11-14 US disclosed
US-20210171668-A1 MECHANICALLY INTERLOCKED MOLECULES-BASED MATERIALS FOR 3-D PRINTING TRUSTEES OF DARTMOUTH COLLEGE (US) 2021-06-10 US disclosed
US-10954315-B2 Mechanically interlocked molecules-based materials for 3-D printing TRUSTEES OF DARTMOUTH COLLEGE (US) 2021-03-23 US disclosed
US-10828399-B2 Three dimensional printing of supramolecular (hydro)gels THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2020-11-10 US disclosed
US-20200131383-A1 THREE-DIMENSIONAL PRINTING WITH SUPRAMOLECULAR TEMPLATED HYDROGELS TRUSTEES OF DARTMOUTH COLLEGE (US) 2020-04-30 US disclosed
US-20190144569-A1 MECHANICALLY INTERLOCKED MOLECULES-BASED MATERIALS FOR 3-D PRINTING TRUSTEES OF DARTMOUTH COLLEGE 2019-05-16 US disclosed
WO-2018200944-A1 THREE-DIMENSIONAL PRINTING WITH SUPRAMOLECULAR TEMPLATED HYDROGELS THE TRUSTEES OF DARTMOUTH COLLEGE (US) 2018-11-01 WO disclosed
US-20150202299-A1 STABILIZING SHEAR-THINNING HYDROGELS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2015-07-23 US disclosed
WO-2014028209-A1 STABILIZING SHEAR-THINNING HYDROGELS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2014-02-20 WO disclosed
US-8030410-B2 Reacting anionic living end polymer that is end capped with steric hindering carbonyl-containing compound to produce polymer with homolytically cleaveable group; engineering plastics BRIDGESTONE CORPORATION (JP) 2011-10-04 US disclosed
US-7737218-B2 Method for generating free radical capable polymers using tin or silicon halide compounds BRIDGESTONE CORPORATION (JP) 2010-06-15 US disclosed
US-7560509-B2 Method of directing grafting by controlling the location of high vinyl segments in a polymer BRIDGESTONE CORPORATION (JP) 2009-07-14 US disclosed
US-7396887-B1 Insitu removal of chelator from anionic polymerization reactions BRIDGESTONE CORPORATION (JP) 2008-07-08 US disclosed
US-20080161495-A1 Method for Generating Free Radical Capable Polymers Using Tin or Silicon Halide Compounds BRIDGESTONE CORPORATION (JP) 2008-07-03 US disclosed
US-20080161484-A1 Method of Directing Grafting by Controlling the Location of High Vinyl Segments in a Polymer BRIDGESTONE CORPORATION (JP) 2008-07-03 US disclosed
US-20080161501-A1 Method for generating free radical capable polymers using carbonyl-containing compounds BRIDGESTONE CORPORATION (JP) 2008-07-03 US disclosed
US-20080161455-A1 INSITU REMOVAL OF CHELATOR FROM ANIONIC POLYMERIZATION REACTIONS BRIDGESTONE CORPORATION (JP) 2008-07-03 US disclosed