Vanillin

Vanillin

SCHEMBL4442606

COc1cc(C=O)ccc1O.Cl

nearest known ligand 0.96

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Vanillin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 known ✓ P28845 2/20 0.62
TTR known ✓ P02766 1/20 0.61
CA2 known ✓ P00918 2/20 0.60
HDAC3 known ✓ O15379 1/20 0.58
EGFR known ✓ P00533 1/20 0.58
GAA known ✓ P10253 1/20 0.58
TOP2A known ✓ P11388 1/20 0.58
MAOA known ✓ P21397 1/20 0.58
PTGS1 known ✓ P23219 1/20 0.58
MAOB known ✓ P27338 1/20 0.58
PTGS2 known ✓ P35354 1/20 0.58
MMP13 known ✓ P45452 1/20 0.58
HDAC4 known ✓ P56524 1/20 0.58
PRKCE known ✓ Q02156 1/20 0.58
PRKCQ known ✓ Q04759 1/20 0.58
PRKCD known ✓ Q05655 1/20 0.58
HDAC1 known ✓ Q13547 1/20 0.58
HDAC7 known ✓ Q8WUI4 1/20 0.58
HDAC2 known ✓ Q92769 1/20 0.58
HDAC10 known ✓ Q969S8 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 SCHEMBL2845894 0.98 ALDH1A1 (0.93) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL1213 0.98 ALDH1A1 (1.00) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL720723 0.98 ALDH1A1 (1.00) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL29354839 0.98 ALDH1A1 (1.00) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL28387598 0.96 ALDH1A1 (0.89) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL19411839 0.96 ALDH1A1 (0.96) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL8853913 0.96 ALDH1A1 (0.96) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL19149274 0.96 ALDH1A1 (0.96) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL20549709 0.96 ALDH1A1 (0.96) ALDH1A1HPGDTDP1TRIM24ALDH5A1
Vanillin SCHEMBL2907529 0.96 ALDH1A1 (0.96) 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 98 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116008227-A Method for rapidly detecting procyanidine content of whole peanut seed coats 山东鲁花花生产业技术研究院有限公司 2023-04-25 CN claimed
CN-110879269-B Combined identification method of cranberry extract 浙江尖峰健康科技有限公司 2022-04-08 CN claimed
CN-114184773-A Method for screening macroporous resin for purifying ephedrine 内蒙古自治区农牧业科学院 2022-03-15 CN claimed
CN-110879269-A Combined identification method of cranberry extract 浙江尖峰健康科技有限公司 2020-03-13 CN claimed
CN-109211719-A A kind of green tea and its for tea component analysis method 信阳师范学院 2019-01-15 CN claimed
CN-102764356-A Method for discriminating Wenweishu capsules JIANGUANG GU 2012-11-07 CN claimed
CN-101183098-A Detection method of chloromycetin eyedrops NAN FANG (CN) 2008-05-21 CN claimed
CN-101073605-A Bistort Rhizome effective component and its use SHENYANG MEDICINAL SCIENCE UNI (CN) 2007-11-21 CN claimed
CN-1726962-A Method for controlling quality of cudrania wood and preparation PU GUIBAO (CN) 2006-02-01 CN claimed
JP-8259557-A None JP disclosed
US-20260108574-A1 HERBAL COMPOSITION FOR TREATING METABOLIC DISORDERS IN MAMMALS M/S NATURAL AND ESSENTIAL OILS PRIVATE LIMITED (IN) 2026-04-23 US disclosed
US-20250354109-A1 A PREPARATION METHOD OF SILAGE GUIZHOU UNIVERSITY (CN) 2025-11-20 US disclosed
US-20250270485-A1 BREWING WITH THERMOSTABLE AMG VARIANTS NOVOZYMES A/S (DK) 2025-08-28 US disclosed
US-12398365-B2 Lactiplantibacillus plantarum for degrading tannins and saponins, and use thereof UNIV GUIZHOU (CN) 2025-08-26 US disclosed
EP-0815857-B1 ANTIOBESTIC AGENT CONTAINING PROCYANIDIN AS THE ACTIVE INGREDIENT SUNTORY LTD (JP) 2004-09-29 EP disclosed
EP-1222865-A1 ELEMENT FOR CIGARETTE SMOKE AND PROCESS FOR PRODUCING THE SAME Daicel Chemical Industries, Ltd. (JP) 2002-07-17 EP disclosed
US-6420181-B1 DETECTING PREFERENTIAL PARTICLE IN SOLUTION; OBTAIN SOLUTION CONTAINING PARTICLE, MIX WITH SOLVENT, INSERT INTO TUBE, INCUBATE WITH CHROMOGENIC DETECTION INDICATOR, MONITOR SAMPLE FOR SIGNAL THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY 2002-07-16 US disclosed
US-6294190-B1 TAMARIND SEED COAT EXTRACT, SUNTORY LIMITED (JP) 2001-09-25 US disclosed
EP-0815857-A1 ANTIOBESTIC AGENT CONTAINING PROCYANIDIN AS THE ACTIVE INGREDIENT SUNTORY LIMITED (JP) 1998-01-07 EP disclosed
JP-H08259557-A NEW TANNINS AND INHIBITOR TO LIPASE CONTAINING THE SAME AS ACTIVE INGREDIENT LOTTE CO LTD 1996-10-08 JP disclosed

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

For each of this compound's patents that has machine-readable text (1 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-20260108574-A1 HERBAL COMPOSITION FOR TREATING METABOLIC DISORDERS IN MAMMALS LIPC, ADIPOR2, ADIPOR1 HSD11B1 748/4885TTR 1898/4885CA2 1979/4885

“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.