Acetaldehyde

Acetaldehyde

SCHEMBL9420985

C=COC(C)=O.C=COC(C)=O.C=COC(C)=O.CC=O.CC=O

nearest known ligand 0.38

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Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 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
Propene SCHEMBL1261018 0.92
Propene SCHEMBL28606624 0.92 ALDH1A1 (0.40) ALDH1A1TSHRHSD17B10TDP1
SCHEMBL1438 0.91
SCHEMBL7529535 0.91 ALDH1A1 (0.44) ALDH1A1TSHRHSD17B10TDP1
Propene SCHEMBL28584706 0.89 ALDH1A1 (0.38) ALDH1A1TSHRHSD17B10TDP1
Formic Acid SCHEMBL29289352 0.89 ALDH1A1 (0.38) ALDH1A1TSHRHSD17B10TDP1
Propene SCHEMBL8418275 0.89 ALDH1A1 (0.38) ALDH1A1TSHRHSD17B10TDP1
Formic Acid SCHEMBL9170455 0.89
SCHEMBL25416150 0.88
Ethylene SCHEMBL10382764 0.88 ALDH1A1 (0.42) ALDH1A1TSHRHSD17B10TDP1

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-5376703-A Saponification, basicification and distillation to degass the acetaldehyde HOECHST AG (DE) 1994-12-27 US disclosed