Acrylic Acid

Acrylic Acid

SCHEMBL6631376

C=CC(=O)O.O=S(=O)(c1ccc(SCCO)cc1)c1ccc(SCCO)cc1

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA2 P00918 10/20 0.57
CA12 O43570 3/20 0.57
CA1 P00915 3/20 0.57
CA7 P43166 3/20 0.57
CA13 Q8N1Q1 3/20 0.57
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 3/20 0.36
APEX1 P27695 2/20 0.35

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
SCHEMBL3137976 0.87 CA2 (0.72) CA2CA12CA1CA7CA13
SCHEMBL811988 0.82 CA2 (0.66) CA2CA12CA1CA7CA13
Acrylic Acid SCHEMBL28466890 0.82 ALDH1A1 (0.50) CA2CA12CA1CA7CA13
SCHEMBL3674803 0.78 CA2 (0.41) CA2CA12CA1CA7CA13
SCHEMBL556755 0.77 THRB (0.42) CA2CA12CA1CA7CA13
SCHEMBL3137951 0.77 CA2 (0.59) CA2CA12CA1CA7CA13
SCHEMBL14351561 0.76 CA2 (0.74) CA2CA12CA1CA7CA13
SCHEMBL14351637 0.75 CA2 (0.43) CA2CA12CA1CA7CA13
SCHEMBL13696518 0.75 CA2 (0.49) CA2CA12CA1CA7CA13
SCHEMBL15452120 0.74 THRB (0.39) CA2CA12CA1CA7CA13

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
JP-2004115713-A POLYMERIZABLE COMPOSITION AND ITS CURED PRODUCT MITSUBISHI CHEMICALS CORP 2004-04-15 JP disclosed