Acrylic Acid

Acrylic Acid

SCHEMBL28021135

C=CC(=O)O.COc1cccc(OC)c1C(C)C

nearest known ligand 0.65

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.65
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
CA12 O43570 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
KMT2A Q03164 1/20 0.46
ACHE P22303 2/20 0.42
HDAC4 P56524 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.40
LPAR1 Q92633 1/20 0.40
HPGD P15428 2/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
TLR2 O60603 1/20 0.40
ERN1 O75460 1/20 0.40

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
Formaldehyde SCHEMBL27577576 0.85 KDM4E (0.53) KDM4ECA1CA2CA12CA7
1,2-Dimethoxybenzene SCHEMBL29004764 0.83 CA1 (0.56) KDM4ECA1CA2CA12CA7
Methyl Alcohol SCHEMBL27577395 0.82 KDM4E (0.54) KDM4ECA1CA2CA12CA7
SCHEMBL9814047 0.82 KDM4E (0.53) KDM4ECA1CA2CA12CA7
Propionic Acid SCHEMBL27946489 0.82 KDM4E (0.56) KDM4ECA1CA2CA12CA7
Acrylic Acid SCHEMBL29034262 0.81 NFE2L2 (0.53) KDM4ECA1CA2CA12CA7
Syringol SCHEMBL29241935 0.81 KDM4E (0.55) KDM4ECA1CA2CA12CA7
Bromide SCHEMBL28922144 0.80 KDM4E (0.51) KDM4ECA1CA2CA12CA7
Acrylic Acid SCHEMBL29034269 0.80 NFE2L2 (0.51) KDM4ECA1CA2CA12CA7
SCHEMBL27774616 0.79 KDM4E (0.53) KDM4ECA1CA2CA12CA7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104744243-B (E)-2-phenyl-3-(3,5-dimethoxy-4 '-isopropyl benzene) purification method of propenoic acid HEBEI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-04-06 CN disclosed
CN-104744243-A Purifying method of (E)-2-phenyl-3-(3,5-dimethoxy-4-isopropyl benzene) crylic acid UNIV HEBEI SCIENCE & TECH 2015-07-01 CN disclosed