2-Ethylhexanoic Acid

2-Ethylhexanoic Acid

SCHEMBL31730242

CCCCC(CC)C(=O)[O-].CCCCCC[P+](CCCC)(CCCC)CCCC

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 9/20 0.75
▸ DNM1 Q05193 2/20 0.56
▸ MAPK1 P28482 1/20 0.52
▸ CA1 P00915 6/20 0.50
▸ CYP3A4 P08684 2/20 0.47
▸ TSHR P16473 2/20 0.47
▸ NFKB1 P19838 2/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ GPR84 Q9NQS5 1/20 0.40

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 SCHEMBL17453704 1.00 CA2 (0.75) CA2DNM1MAPK1CA1CYP3A4
2-Ethylhexanoic Acid SCHEMBL230713 0.94 CA2 (0.84) CA2DNM1MAPK1CA1CYP3A4
SCHEMBL17839033 0.92 CA2 (0.62) CA2DNM1MAPK1CA1CYP3A4
2-Ethylhexanoic Acid SCHEMBL3649881 0.88 CA2 (0.96) CA2MAPK1CA1CYP3A4TSHR
2-Ethylhexanoic Acid SCHEMBL594231 0.88 CA2 (0.88) CA2MAPK1CA1CYP3A4TSHR
2-Ethylhexanoic Acid SCHEMBL25406432 0.87 CA2 (0.72) CA2DNM1MAPK1CA1CYP3A4
SCHEMBL5057190 0.86 CA2 (0.77) CA2MAPK1CA1CYP3A4TSHR
Lithium Ion SCHEMBL22772374 0.86 CA2 (0.77) CA2MAPK1CA1CYP3A4TSHR
SCHEMBL22772366 0.86 CA2 (0.77) CA2MAPK1CA1CYP3A4TSHR
SCHEMBL22772375 0.86 CA2 (0.77) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4650341-A1 ABSORBENT FOR CAPTURING ACID GASES, AND PREPARATION METHOD THEREFOR AND USE THEREOF Zhang, Zhaofu (CN) 2025-11-19 — — EP disclosed
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