Ethaneperoxoic Acid

Ethaneperoxoic Acid

SCHEMBL31099400

CC(=O)OO.CCC(=O)N(C)CCCO

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.33
BCHE P06276 9/20 0.33
ACHE P22303 9/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CHRM2 P08172 2/20 0.32
CHRM1 P11229 1/20 0.32
EPHX2 P34913 2/20 0.30

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
SCHEMBL8633748 0.88 CNR1 (0.39) CNR1BCHEACHEALDH1A1LMNA
SCHEMBL29069580 0.80 EPHX2 (0.40) CNR1BCHEACHEALDH1A1LMNA
SCHEMBL25232294 0.76 ALDH1A1 (0.52) ALDH1A1LMNAHSD17B10CHRM2CHRM1
SCHEMBL7320291 0.75
SCHEMBL2249531 0.74 PAOX (0.37) CNR1EPHX2
SCHEMBL4146764 0.73 ALDH1A1 (0.46) CNR1ALDH1A1EPHX2
SCHEMBL8633444 0.72 CNR1 (0.47) CNR1BCHEACHEALDH1A1EPHX2
SCHEMBL7930805 0.72 ALDH1A1 (0.37) CNR1ALDH1A1LMNAHSD17B10EPHX2
SCHEMBL10288645 0.71 ALDH1A1 (0.39) ALDH1A1EPHX2
SCHEMBL15670632 0.71 EPHX2 (0.35) CNR1BCHEACHEALDH1A1LMNA

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
CN-118679164-A Photodynamic therapy and diagnosis RMW曹氏集团有限公司 2024-09-20 CN disclosed