2-Ethylhexanoic Acid

2-Ethylhexanoic Acid

SCHEMBL3175937

C1CCC(P(C2CCCC2)C2CCCC2)C1.CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Pd+2]

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 9/20 0.62
▸ MAPK1 P28482 1/20 0.43
▸ CA1 P00915 6/20 0.42
▸ CYP3A4 P08684 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ NFKB1 P19838 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ USP2 O75604 1/20 0.35
▸ NAAA Q02083 1/20 0.33

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 SCHEMBL3170701 1.00 CA2 (0.62) CA2MAPK1CA1CYP3A4TSHR
2-Ethylhexanoic Acid SCHEMBL3174647 0.98 CA2 (0.60) CA2MAPK1CA1CYP3A4TSHR
2-Ethylhexanoic Acid SCHEMBL3180453 0.98 CA2 (0.60) CA2MAPK1CA1CYP3A4TSHR
2-Ethylhexanoic Acid SCHEMBL5372716 0.83 CA2 (0.62) CA2MAPK1CA1NAAA
2-Ethylhexanoic Acid SCHEMBL887054 0.82 CA2 (0.91) CA2MAPK1CA1CYP3A4TSHR
2-Ethylhexanoic Acid SCHEMBL3649881 0.80 CA2 (0.96) CA2MAPK1CA1CYP3A4TSHR
2-Ethylhexanoic Acid SCHEMBL31542618 0.78 CA2 (0.84) CA2MAPK1CA1CYP3A4TSHR
2-Ethylhexanoic Acid SCHEMBL230713 0.78 CA2 (0.84) CA2MAPK1CA1CYP3A4TSHR
2-Ethylhexanoic Acid SCHEMBL23802667 0.78 CA2 (0.91) CA2MAPK1CA1CYP3A4TSHR
2-Ethylhexanoic Acid SCHEMBL151983 0.78 CA2 (0.91) CA2MAPK1CA1CYP3A4TSHR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8084563-B2 Cyclic olefin addition copolymer, process for production thereof, and retardation film obtained from the copolymer JSR CORPORATION (JP) 2011-12-27 — — US disclosed
US-20100021707-A1 CYCLIC OLEFIN ADDITION COPOLYMER, METHOD FOR PRODUCING THE SAME, AND RETARDATION FILM OBTAINED FROM THE COPOLYMER JSR CORPORATION (JP) 2010-01-28 — — US disclosed
EP-2039708-A1 CYCLIC OLEFIN ADDITION COPOLYMER, METHOD FOR PRODUCING THE SAME, AND RETARDATION FILM OBTAINED FROM THE COPOLYMER JSR Corporation (JP) 2009-03-25 — — EP disclosed
US-7482412-B2 Process for manufacturing cycloolefin addition polymer JSR CORPORATION (JP) 2009-01-27 — — US disclosed
US-20080085979-A1 PROCESS FOR MANUFACTURING CYCLOOLEFIN ADDITION POLYMER JSR CORPORATION (JP) 2008-04-10 — — US disclosed
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