2-Ethylhexanoic Acid

2-Ethylhexanoic Acid

SCHEMBL5372716

C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CCCCC(CC)C(=O)O

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 7/20 0.62
▸ MAPK1 P28482 2/20 0.62
▸ CA1 P00915 4/20 0.43
▸ SLC1A2 P43004 2/20 0.42
▸ SLC1A1 P43005 2/20 0.42
▸ SLC1A3 P43003 1/20 0.42
▸ GRIK1 P39086 2/20 0.41
▸ GRIK2 Q13002 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ PPARG P37231 1/20 0.40
▸ CHRM1 P11229 1/20 0.37
▸ AKR1A1 P14550 1/20 0.37
▸ CHRM3 P20309 1/20 0.37
▸ HTR2A P28223 1/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ ADRA1A P35348 1/20 0.37
▸ HRH1 P35367 1/20 0.37
▸ DRD3 P35462 1/20 0.37
▸ SLC6A3 Q01959 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37

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 SCHEMBL3180453 0.85 CA2 (0.60) CA2MAPK1CA1ALDH1A1KMT2A
2-Ethylhexanoic Acid SCHEMBL3174647 0.85 CA2 (0.60) CA2MAPK1CA1ALDH1A1KMT2A
2-Ethylhexanoic Acid SCHEMBL3175937 0.83 CA2 (0.62) CA2MAPK1CA1NAAA
2-Ethylhexanoic Acid SCHEMBL3170701 0.83 CA2 (0.62) CA2MAPK1CA1NAAA
2-Ethylhexanoic Acid SCHEMBL27457269 0.83 CA2 (0.83) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL9763737 0.83 CA2 (0.83) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL9439018 0.83 CA2 (0.65) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL11651727 0.83 CA2 (0.65) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL11502267 0.81 CA2 (0.62) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL8391670 0.81 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7268196-B2 Process for producing cycloolefin addition polymer JSR CORPORATION (JP) 2007-09-11 — — US disclosed
US-7241847-B2 Process for producing cycloolefin addition polymer JSR CORPORATION (JP) 2007-07-10 — — US disclosed
US-20070155922-A1 Process for producing cycloolefin addition polymer JSR CORPORATION (JP) 2007-07-05 — — US disclosed
US-20070123667-A1 PROCESS FOR PRODUCING CYCLOOLEFIN ADDITION POLYMER JSR CORPORATION (JP) 2007-05-31 — — US disclosed
EP-1712572-A1 PROCESS FOR PRODUCING CYCLOOLEFIN ADDITION POLYMER JSR Corporation (JP) 2006-10-18 — — EP disclosed
US-20060217505-A1 Process for producing cycloolefin addition polymer JRS CORPORATION (JP) 2006-09-28 — — US disclosed
EP-1657259-A1 PROCESS FOR PRODUCING CYCLOOLEFIN ADDITION POLYMER JSR Corporation (JP) 2006-05-17 — — EP disclosed
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