2-Ethylhexanoic Acid

2-Ethylhexanoic Acid

SCHEMBL516817

CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.[AlH3]

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 SCHEMBL1109635 1.00 CA2 (0.95) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL8929902 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 SCHEMBL301319 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL5695779 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL6121661 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL5512393 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL25800 0.98 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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3914683-A1 DETERGENT COMPOSITIONS HAVING IMPROVED OLFACTORY PROPERTIES Calyxia (FR) 2021-12-01 EP disclosed
EP-3914684-A1 CARE PRODUCT COMPOSITIONS HAVING IMPROVED OLFACTORY PROPERTIES Calyxia (FR) 2021-12-01 EP disclosed
EP-3453746-B1 GEL-FORM COMPOSITION AND WATER ABSORPTION INHIBITOR SHINETSU CHEMICAL CO (JP) 2020-12-09 EP disclosed
US-10808124-B2 Gel-form composition and water absorption inhibitor SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-10-20 US disclosed
EP-3548529-B1 PROCESS FOR PREPARING MICROCAPSULES OF CONTROLLED SIZE COMPRISING A PHOTOPOLYMERIZATION STEP CALYXIA (FR) 2020-10-14 EP disclosed
EP-3697527-A1 METHOD FOR PREPARING CAPSULES SENSITIVE TO PH OR UV RADIATION AND CAPSULES OBTAINED THEREFROM Calyxia (FR) 2020-08-26 EP disclosed
WO-2020152216-A1 DETERGENT COMPOSITIONS HAVING IMPROVED OLFACTORY PROPERTIES CALYXIA (FR) 2020-07-30 WO disclosed
WO-2020152222-A1 CARE PRODUCT COMPOSITIONS HAVING IMPROVED OLFACTORY PROPERTIES CALYXIA (FR) 2020-07-30 WO disclosed
EP-3624932-A1 METHOD FOR PREPARING BIODEGRADABLE CAPSULES AND CAPSULES OBTAINED Calyxia (FR) 2020-03-25 EP disclosed
EP-3600642-A1 METHOD FOR PREPARING CAPSULES WITH IMPROVED RETENTION PROPERTIES AND CAPSULES OBTAINED THEREFROM Calyxia (FR) 2020-02-05 EP disclosed
CN-108137731-A Copolymerization of Polyenes and Olefins 株式会社普利司通 2018-06-08 CN disclosed
WO-2018100196-A1 METHOD FOR PREPARING MICROCAPSULES AND MICROPARTICLES OF CONTROLLED SIZE CALYXIA (FR) 2018-06-07 WO disclosed
WO-2018100179-A1 PROCESS FOR PREPARING MICROCAPSULES OF CONTROLLED SIZE COMPRISING A PHOTOPOLYMERIZATION STEP CALYXIA (FR) 2018-06-07 WO disclosed
EP-2392458-B1 POLYPROPYLENE RESIN MOLDED ARTICLE NEW JAPAN CHEM CO LTD (JP) 2018-03-14 EP disclosed
EP-2808315-B1 GEL COMPOSITION AND A USE THEREOF SHINETSU CHEMICAL CO (JP) 2017-10-18 EP disclosed
US-9029472-B2 Gel composition and a use thereof SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-05-12 US disclosed
US-20140356614-A1 GEL COMPOSITION AND A USE THEREOF SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-12-04 US disclosed
EP-2808315-A1 Gel composition and a use thereof Shin-Etsu Chemical Co., Ltd. (JP) 2014-12-03 EP disclosed
US-20120028006-A1 POLYPROPYLENE RESIN MOLDED ARTICLE NEW JAPAN CHEMICAL CO., LTD. (JP) 2012-02-02 US disclosed
EP-2392458-A2 POLYPROPYLENE RESIN MOLDED ARTICLE New Japan Chemical Co., Ltd. (JP) 2011-12-07 EP disclosed