Ethaneperoxoic Acid

Ethaneperoxoic Acid

SCHEMBL11230331

CC(=O)OO.O=C(OO)C(Cl)(Cl)Cl

nearest known ligand 0.33

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Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
TSHR P16473 3/20 0.33
TP53 P04637 1/20 0.33
THPO P40225 1/20 0.32
LMNA P02545 1/20 0.30
ALOX15 P16050 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 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
SCHEMBL322207 0.88
Ethaneperoxoic Acid SCHEMBL11884206 0.78
SCHEMBL1274243 0.76 ALDH1A1 (0.32) ALDH1A1TSHRTP53
Ethaneperoxoic Acid SCHEMBL28297659 0.75
Ethaneperoxoic Acid SCHEMBL562267 0.74 TSHR (0.55) ALDH1A1TSHRTHPOLMNAALOX15
Ethaneperoxoic Acid SCHEMBL4954376 0.74 TSHR (0.55) ALDH1A1TSHRTHPOLMNAALOX15
Ethaneperoxoic Acid SCHEMBL6912 0.74
SCHEMBL150680 0.74 ALDH1A1 (0.50) ALDH1A1TSHRTP53
SCHEMBL11648369 0.72 ALDH1A1 (0.33) ALDH1A1TSHRTP53
Ethaneperoxoic Acid SCHEMBL5525183 0.72 ALDH1A1 (0.33) ALDH1A1TSHRTHPO

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
US-4321128-A REGENERATION ATLANTIC RICHFIELD COMPANY (US) 1982-03-23 US disclosed