3,4-Dimethoxybenzaldehyde

3,4-Dimethoxybenzaldehyde

SCHEMBL27908009

COc1cc(C=O)ccc1O.COc1ccc(C=O)cc1OC

nearest known ligand 0.89

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.89
TRIM24 O15164 1/20 0.89
HPGD P15428 1/20 0.89
ALDH5A1 P51649 1/20 0.89
ABAT P80404 1/20 0.89
TDP1 Q9NUW8 1/20 0.89
TRIM33 Q9UPN9 1/20 0.89
TSHR P16473 1/20 0.79
AOX1 Q06278 1/20 0.71
XDH P47989 1/20 0.63
FDPS P14324 1/20 0.62
TRPA1 O75762 1/20 0.61
TYR P14679 1/20 0.59
GLO1 Q04760 1/20 0.58
IKBKB O14920 1/20 0.58
CHUK O15111 1/20 0.58
IKBKG Q9Y6K9 1/20 0.58
NFE2L2 Q16236 2/20 0.58
CYP1A2 P05177 1/20 0.58
ALOX5 P09917 1/20 0.58

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
Vanillin SCHEMBL1213 0.94 ALDH1A1 (1.00) ALDH1A1TRIM24HPGDALDH5A1ABAT
Vanillin SCHEMBL29354839 0.94 ALDH1A1 (1.00) ALDH1A1TRIM24HPGDALDH5A1ABAT
Vanillin SCHEMBL720723 0.94 ALDH1A1 (1.00) ALDH1A1TRIM24HPGDALDH5A1ABAT
Vanillin SCHEMBL19149274 0.93 ALDH1A1 (0.96) ALDH1A1TRIM24HPGDALDH5A1ABAT
Vanillin SCHEMBL11269339 0.93 ALDH1A1 (0.96) ALDH1A1TRIM24HPGDALDH5A1ABAT
Vanillin SCHEMBL19411839 0.93 ALDH1A1 (0.96) ALDH1A1TRIM24HPGDALDH5A1ABAT
Vanillin SCHEMBL8853913 0.93 ALDH1A1 (0.96) ALDH1A1TRIM24HPGDALDH5A1ABAT
Vanillin SCHEMBL20549709 0.93 ALDH1A1 (0.96) ALDH1A1TRIM24HPGDALDH5A1ABAT
Vanillin SCHEMBL19260053 0.93 ALDH1A1 (0.96) ALDH1A1TRIM24HPGDALDH5A1ABAT
Vanillin SCHEMBL8854077 0.93 ALDH1A1 (0.96) ALDH1A1TRIM24HPGDALDH5A1ABAT

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-103172525-B Preparation method of ethyl vanillin antigen and antibody, and application of ethyl vanillin antigen and antibody UNIV SOUTH CHINA AGRICULT 2014-12-31 CN disclosed
CN-103172525-A Preparation method of ethyl vanillin antigen and antibody, and application of ethyl vanillin antigen and antibody UNIV SOUTH CHINA AGRICULT 2013-06-26 CN disclosed