Vanillin

Vanillin

SCHEMBL705158

CCOC(C)OCC.COc1cc(C=O)ccc1O

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.71
HPGD P15428 2/20 0.71
TDP1 Q9NUW8 2/20 0.71
TRIM24 O15164 1/20 0.71
ALDH5A1 P51649 1/20 0.71
ABAT P80404 1/20 0.71
TRIM33 Q9UPN9 1/20 0.71
AOX1 Q06278 1/20 0.54
XDH P47989 1/20 0.52
MAOB P27338 2/20 0.52
TSHR P16473 3/20 0.50
CYP2D6 P10635 3/20 0.50
APP P05067 3/20 0.50
MAPT P10636 3/20 0.50
CYP2C9 P11712 2/20 0.50
HSD17B10 Q99714 2/20 0.50
CYP1A2 P05177 2/20 0.50
ALOX5 P09917 2/20 0.50
TYR P14679 2/20 0.50
NFKB1 P19838 2/20 0.50

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 SCHEMBL8740810 0.97 ALDH1A1 (0.68) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL8740783 0.97 ALDH1A1 (0.68) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL3276975 0.96 ALDH1A1 (0.66) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL4665476 0.95 ALDH1A1 (0.64) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL8740773 0.95 ALDH1A1 (0.64) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL432750 0.94 ALDH1A1 (0.62) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL4665586 0.94 ALDH1A1 (0.62) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL118411 0.94 ALDH1A1 (0.62) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL11130854 0.92 ALDH1A1 (0.61) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL5921468 0.90 ALDH1A1 (0.58) ALDH1A1HPGDTDP1TRIM24ALDH5A1

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 169 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110551273-B Preparation method of dual-stimulus-response polyurethane micelle 齐鲁工业大学 2021-05-11 CN claimed
CN-110551273-A Preparation method of dual-stimulus-response polyurethane micelle UNIV QILU TECHNOLOGY 2019-12-10 CN claimed
EP-2423290-B1 COMPOSITION COMPRISING 1-MENTHYL (3S)-3-HYDROXYBUTANOATE FOR STIMULATING SENSE TAKASAGO PERFUMERY CO LTD (JP) 2019-05-22 EP claimed
CN-105037299-B A kind of 3,4 7-oxa-bicyclo[4.1.0 base dimethoxym ethane glycol and its preparation method and use 岳阳昌德化工实业有限公司 2017-10-27 CN claimed
US-20170273323-A1 PRESERVATION OF MEAT PRODUCTS PURAC BIOCHEM B.V. (NL) 2017-09-28 US claimed
CN-105016986-B A kind of purposes of (hydroxyl of 3 alkoxy 4) cyclohexyl dimethoxym ethane glycol and its isomers 岳阳昌德化工实业有限公司 2017-07-18 CN claimed
EP-2995201-A1 Preservation of meat products with a composition comprising a vanilin and a cinnamate component Purac Biochem B.V. (NL) 2016-03-16 EP claimed
WO-2016036244-A1 PRESERVATION OF MEAT PRODUCTS WITH A COMPOSITION COMPRISING A VANILIN AND A CINNAMATE COMPONENT PURAC BIOCHEM B.V. (NL) 2016-03-10 WO claimed
CN-105037299-A 3,4-epoxy cyclohexyl methylal diol, and synthesis method and application thereof Yueyang changde chemical industry co ltd 2015-11-11 CN claimed
CN-105037117-A Method for simultaneously synthesizing vanillin and isovanillin Yueyang changde chemical industry co ltd 2015-11-11 CN claimed
US-20100280110-A1 (3R)-L-MENTHYL 3-HYDROXYBUTYRATE, PROCESS FOR PRODUCING THE SAME, AND SENSATE COMPOSITION COMPRISING THE SAME TAKASAGO INTERNATIONAL CORPORATION (JP) 2010-11-04 US claimed
CN-101781281-A Synthesis method for optically active vanillin acetal flavor UNIV HEFEI TECHNOLOGY 2010-07-21 CN claimed
US-20090208427-A1 Vanillin Acetals and Sensory Stimulant Composition Containing the Same TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-08-20 US claimed
CN-101218222-A Vanillin acetals and sensory stimulant composition containing the same TAKASAGO PERFUMERY CO LTD (JP) 2008-07-09 CN claimed
EP-1902043-A1 VANILLIN ACETALS AND SENSORY STIMULANT COMPOSITION CONTAINING THE SAME Takasago International Corporation (JP) 2008-03-26 EP claimed
WO-2007004740-A1 VANILLIN ACETALS AND SENSORY STIMULANT COMPOSITION CONTAINING THE SAME TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-01-11 WO claimed
US-6239087-B1 COMPOSITIONS CONTAINING CERTAIN ACETALS OR KETALS WHICH HYDROLYZE UPON EXPOSURE OF SURFACES WASHED IN SOLUTION OF SAID COMPOSITIONS TO REDUCTION IN PH, THEREBY RELEASING FRAGRANCE CHARACTERISTIC OF ONE OR MORE OF HYDROLYSIS PRODUCTS THE PROCTER & GAMBLE COMPANY 2001-05-29 US claimed
EP-1096004-A2 Pro-fragrance compounds THE PROCTER & GAMBLE COMPANY (US) 2001-05-02 EP claimed
EP-0888439-A1 DETERGENT COMPOSITIONS CONTAINING FRAGRANCE PRECURSORS AND THE FRAGRANCE PRECURSORS THEMSELVES THE PROCTER & GAMBLE COMPANY (US) 1999-01-07 EP claimed
WO-1997034986-A1 DETERGENT COMPOSITIONS CONTAINING FRAGRANCE PRECURSORS AND THE FRAGRANCE PRECURSORS THEMSELVES THE PROCTER & GAMBLE COMPANY (US) 1997-09-25 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100280110-A1 (3R)-L-MENTHYL 3-HYDROXYBUTYRATE, PROCESS FOR PRODUCING THE SAME, AND SENSATE COMPOSITION COMPRISING THE SAME LRBA, HCAR3, PHGDH ALDH1A1 132/4885HPGD 657/4885TDP1 3897/4885
US-20090208427-A1 Vanillin Acetals and Sensory Stimulant Composition Containing the Same TRPA1, TRPV1, TAS2R5 ALDH1A1 70/4885HPGD 3093/4885TDP1 1364/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.