Acrylic Acid

Acrylic Acid

SCHEMBL30697274

C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.CC(CCO)CCO

nearest known ligand 0.48

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
ALDH1A1 P00352 4/20 0.45
ALOX15 P16050 3/20 0.45
HSD17B10 Q99714 1/20 0.37
TSHR P16473 5/20 0.35
TRPA1 O75762 1/20 0.35
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRA1 P14867 2/20 0.34
GABRB1 P18505 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRA3 P34903 2/20 0.34
GABRA2 P47869 2/20 0.34
GABRB2 P47870 2/20 0.34
GABRA4 P48169 2/20 0.34
GABRE P78334 2/20 0.34
GABRA6 Q16445 2/20 0.34
GABRG1 Q8N1C3 2/20 0.34

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
Acrylic Acid SCHEMBL11962994 1.00 LMNA (0.48) LMNAALDH1A1ALOX15HSD17B10TSHR
3-Methylbutanol SCHEMBL27167097 0.86 LMNA (0.48) LMNAALDH1A1ALOX15HSD17B10TSHR
Acrylic Acid SCHEMBL28509471 0.84 LMNA (0.37) LMNAALDH1A1ALOX15HSD17B10TRPA1
1,3-Butanediol SCHEMBL659565 0.84 LMNA (0.46) LMNAALDH1A1ALOX15HSD17B10TSHR
1,3-Butanediol SCHEMBL3883350 0.84 LMNA (0.46) LMNAALDH1A1ALOX15HSD17B10TSHR
Maleic Acid SCHEMBL28379908 0.83 ALDH1A1 (0.46) ALDH1A1ALOX15TSHRTRPA1GABRP
Bicarbonate SCHEMBL18224038 0.82 ALDH1A1 (0.48) ALDH1A1ALOX15TSHRTRPA1GABRP
Acrylic Acid SCHEMBL29578281 0.80 LMNA (0.53) LMNAALDH1A1ALOX15HSD17B10TSHR
Acrylic Acid SCHEMBL28283447 0.80 LMNA (0.53) LMNAALDH1A1ALOX15HSD17B10TSHR
Acetic Acid SCHEMBL7950964 0.79 ALDH1A1 (0.52) ALDH1A1ALOX15TRPA1GABRPGABRD

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
WO-2024004918-A1 RESIN COMPOSITION, SURFACE TREATMENT METHOD, AND METHOD FOR PRODUCING MATERIAL INCLUDING CURED COATING FILM 株式会社レゾナック 2024-01-04 WO disclosed