Thymol

Thymol

SCHEMBL6057517

Cc1ccc(C(C)C)c(O)c1.O=Cc1ccccc1O

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.64
▸ TRPA1 O75762 1/20 0.64
▸ CHRM1 P11229 1/20 0.64
▸ SLC6A2 P23975 1/20 0.64
▸ ADRA1A P35348 1/20 0.64
▸ HTR2B P41595 1/20 0.64
▸ TRIM24 O15164 1/20 0.55
▸ TRIM33 Q9UPN9 1/20 0.55
▸ KMT2A Q03164 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ THRB P10828 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ HIF1A Q16665 1/20 0.48
▸ GABRA1 P14867 1/20 0.46

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
Thymol SCHEMBL28208247 0.94 LMNA (0.68) LMNATRPA1CHRM1SLC6A2ADRA1A
Thymol SCHEMBL16915470 0.89 TYR (0.52) LMNATRPA1CHRM1SLC6A2ADRA1A
Thymol SCHEMBL16915452 0.89 TYR (0.52) LMNATRPA1CHRM1SLC6A2ADRA1A
Thymol SCHEMBL28207758 0.88 LMNA (0.60) LMNATRPA1CHRM1SLC6A2ADRA1A
Thymol SCHEMBL28857938 0.88 LMNA (0.60) LMNATRPA1CHRM1SLC6A2ADRA1A
Thymol SCHEMBL6057705 0.85 TYR (0.48) LMNATRPA1CHRM1SLC6A2ADRA1A
Salicyladehyde SCHEMBL7090644 0.84 TRIM24 (0.67) LMNATRPA1TRIM24TRIM33KMT2A
Thymol SCHEMBL15012878 0.84 LMNA (0.84) LMNATRPA1CHRM1SLC6A2ADRA1A
Thymol SCHEMBL23045245 0.82 LMNA (0.81) LMNATRPA1CHRM1SLC6A2ADRA1A
Thymol SCHEMBL22165 0.80 LMNA (1.00) LMNATRPA1CHRM1SLC6A2ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3094176-A1 ANTIMICROBIAL COMPOSITIONS FOR FOOD PACKAGING CONSISTING OF SALICYLALDEHYDE AND CARVACROL, THYMOL OR THEIR MIXTURE INSTITUTO TECNOLÓGICO DEL EMBALAJE, TRANSPORTE Y LOGÍSTICA (ITENE) (ES) 2016-11-23 — — EP claimed
US-20160325911-A1 ANTIMICROBIAL COMPOSITIONS FOR FOOD PACKAGING CONSISTING OF SALICYLALDEHYDE AND CARVACROL, THYMOL OR THEIR MIXTURE INSTITUO TECHNOLOGICO DEL EMBALAJE TRANSPORTE Y LOGISTICA (ITENE) (ES) 2016-11-10 — — US claimed
WO-2015107089-A1 ANTIMICROBIAL COMPOSITIONS FOR FOOD PACKAGING CONSISTING OF SALICYLALDEHYDE AND CARVACROL, THYMOL OR THEIR MIXTURE INSTITUTO TECNOLÓGICO DEL EMBALAJE, TRANSPORTE Y LOGÍSTICA (ITENE) (ES) 2015-07-23 — — WO claimed
US-6638904-B2 Composition capable of eliminating one or more microorganisms from solid or semi-solid surface or three-space also including organoleptically-compatible antimicrobial synergism cofactor substance INTERNATIONAL FLAVORS & FRAGRANCES INC. 2003-10-28 — — US claimed
EP-3094176-A1 ANTIMICROBIAL COMPOSITIONS FOR FOOD PACKAGING CONSISTING OF SALICYLALDEHYDE AND CARVACROL, THYMOL OR THEIR MIXTURE INSTITUTO TECNOLÓGICO DEL EMBALAJE, TRANSPORTE Y LOGÍSTICA (ITENE) (ES) 2016-11-23 — — EP disclosed
US-20160325911-A1 ANTIMICROBIAL COMPOSITIONS FOR FOOD PACKAGING CONSISTING OF SALICYLALDEHYDE AND CARVACROL, THYMOL OR THEIR MIXTURE INSTITUO TECHNOLOGICO DEL EMBALAJE TRANSPORTE Y LOGISTICA (ITENE) (ES) 2016-11-10 — — US disclosed
WO-2015107089-A1 ANTIMICROBIAL COMPOSITIONS FOR FOOD PACKAGING CONSISTING OF SALICYLALDEHYDE AND CARVACROL, THYMOL OR THEIR MIXTURE INSTITUTO TECNOLÓGICO DEL EMBALAJE, TRANSPORTE Y LOGÍSTICA (ITENE) (ES) 2015-07-23 — — WO disclosed
EP-1172118-B1 Salicylaldehyde-containing composition having antimicrobial and fragrancing properties and process for using same INT FLAVORS & FRAGRANCES INC (US) 2006-01-25 — — EP disclosed
US-20040059005-A1 Salicylaldehyde-containing composition having antimicrobial and fragrancing properties and process for using same WHITE MICHAEL JOHN ROBERT (NL) 2004-03-25 — — US disclosed
US-6638904-B2 Composition capable of eliminating one or more microorganisms from solid or semi-solid surface or three-space also including organoleptically-compatible antimicrobial synergism cofactor substance INTERNATIONAL FLAVORS & FRAGRANCES INC. 2003-10-28 — — US disclosed
US-20030156975-A1 Salicylaldehyde-containing composition having antimicrobial and fragrancing properties and process for using same WHITE MICHAEL JOHN ROBERT (NL) 2003-08-21 — — US disclosed
US-6495512-B1 EMITTING AESTHETICALLY PLEASING AROMAS AND SIMULTANEOUSLY ELIMINATING SPECIFIC BACTERIA INCLUDING ESCHERICHIA COLI, ENTEROCOCCUS HIRAE, PSEUDOMONAS AERUGINOSA, STAPHYLOCOCCUS AUREUS AND SACCHAROMYCES CEREVISAE INTERNATIONAL FLAVORS & FRAGRANCES INC. 2002-12-17 — — US disclosed
EP-1172118-A2 Salicylaldehyde-containing composition having antimicrobial and fragrancing properties and process for using same INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2002-01-16 — — EP 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-20040059005-A1 Salicylaldehyde-containing composition having antimicrobial and fragrancing properties and process for using same CUTA, SUCLG1, POLR1C LMNA 3645/4885TRPA1 175/4885CHRM1 1911/4885

“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.

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