SCHEMBL624310

SCHEMBL624310

CC(CCCO)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 5/20 0.60
RIPK1 Q13546 1/20 0.53
TAAR1 Q96RJ0 3/20 0.50
AOC3 Q16853 2/20 0.45
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL30148108 1.00 TRPA1 (0.60) TRPA1RIPK1TAAR1AOC3ALDH1A1
SCHEMBL1144321 0.94 TRPA1 (0.58) TRPA1RIPK1TAAR1AOC3ALDH1A1
SCHEMBL29263718 0.92 TRPA1 (0.56) TRPA1RIPK1TAAR1AOC3ALDH1A1
SCHEMBL8160187 0.88 PTGS2 (0.52) TRPA1
SCHEMBL81404 0.86 TRPA1 (0.70) TRPA1RIPK1TAAR1AOC3ALDH1A1
SCHEMBL8235394 0.86 TRPA1 (0.70) TRPA1RIPK1TAAR1AOC3ALDH1A1
SCHEMBL3607526 0.86 TRPA1 (0.70) TRPA1RIPK1TAAR1AOC3ALDH1A1
SCHEMBL29224028 0.84 TRPA1 (0.79) TRPA1RIPK1TAAR1AOC3ALDH1A1
Hydrogen Peroxide SCHEMBL2352490 0.83 RIPK1 (0.53) TRPA1RIPK1TAAR1AOC3ALDH1A1
SCHEMBL6280516 0.81 RIPK1 (0.67) TRPA1RIPK1TAAR1AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023030740-A1 AEROSOLSPRAY BEIERSDORF AG (DE) 2023-03-09 WO claimed
EP-4140594-A1 AEROSOLSPRAY Beiersdorf AG (DE) 2023-03-01 EP claimed
EP-4076124-A1 METHODS FOR CLEANING AND CARING FOR AN AUTOMATIC DISHWASHER Henkel AG & Co. KGaA (DE) 2022-10-26 EP claimed
EP-3958826-A1 DEODORANT OR ANTIPERSPIRANT COMPOSITION CONTAINING A CALCIUM OR LACTATE DONOR Beiersdorf AG (DE) 2022-03-02 EP claimed
CN-110144139-B Zinc oxide-based nanoparticle ink and photoelectric device 纳晶科技股份有限公司 2022-01-18 CN claimed
EP-3914685-A1 MULTI-COMPONENT CLEANING SYSTEM Henkel AG & Co. KGaA (DE) 2021-12-01 EP claimed
US-20210348088-A1 Multi-Component Cleaning System HENKEL AG & CO. KGAA (DE) 2021-11-11 US claimed
US-20210324307-A1 Multi-Component Cleaning System HENKEL AG & CO. KGAA (DE) 2021-10-21 US claimed
EP-3884021-A1 MULTI-COMPONENT CLEANING SYSTEM Henkel AG & Co. KGaA (DE) 2021-09-29 EP claimed
EP-3393427-B1 METHOD OF REDUCING PERSPIRATION BEIERSDORF AG (DE) 2021-09-08 EP claimed
EP-1898965-B1 DEVICE FOR THE DOSED INTRODUCTION OF A SOLID FRAGRANCE DURING THE RINSING AND DRYING PHASES IN DISHWASHERS BELL FLAVORS & FRAGRANCES DUFT (DE) 2009-08-19 EP claimed
EP-1688127-B1 Hair treatment composition containing an aromatic alcohol, an aromatic carboxylic acid an organic UV filter OREAL (FR) 2009-04-22 EP claimed
US-20090088357-A1 Device for fragrancing automatic dishwashers and for improving the pearl-off performace of the rinsing water during the drying phase BELL FLAVORS & FRAGRANCES DUFT UND AROMA GMBH (DE) 2009-04-02 US claimed
JP-2008541894-A 2008-11-27 JP claimed
CN-101212989-A Agent for use in dishwashers and device for the dosed introduction thereof during the rinsing and drying phases BELL FLAVORS & FRAGRANCES DUFT (DE) 2008-07-02 CN claimed
EP-1898965-A2 AGENT FOR USE IN DISHWASHERS AND DEVICE FOR THE DOSED INTRODUCTION THEREOF DURING THE RINSING AND DRYING PHASES Bell Flavors & Fragrances Duft und Aroma GmbH (DE) 2008-03-19 EP claimed
WO-2006128506-A2 AGENT FOR USE IN DISHWASHERS AND DEVICE FOR THE DOSED INTRODUCTION THEREOF DURING THE RINSING AND DRYING PHASES BELL FLAVORS & FRAGRANCES DUFT UND AROMA GMBH (DE) 2006-12-07 WO claimed
US-20060182697-A1 Composition for treating keratin fibers, comprising at least one aromatic alcohol, at least one aromatic carboxylic acid, and at least one protecting agent L'OREAL S.A. (FR) 2006-08-17 US claimed
EP-1688127-A1 Hair treatment composition containing an aromatic alcohol, an aromatic carboxylic acid a protecting agent L'OREAL (FR) 2006-08-09 EP claimed
EP-0048572-A2 Substituted 2-hydroxyphenyl cycloalkanes and pharmaceutical compositions thereof PFIZER INC. (US) 1982-03-31 EP 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 (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-20060182697-A1 Composition for treating keratin fibers, comprising at least one aromatic alcohol, at least one aromatic carboxylic acid, and at least one protecting agent KRT18, TYR, ADH1C TRPA1 148/4885RIPK1 4445/4885TAAR1 459/4885

“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.