SCHEMBL81404

SCHEMBL81404

CC(CCO)c1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 5/20 0.70
RIPK1 Q13546 1/20 0.57
TAAR1 Q96RJ0 3/20 0.54
AOC3 Q16853 2/20 0.48
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL3607526 1.00 TRPA1 (0.70) TRPA1RIPK1TAAR1AOC3KDM4E
SCHEMBL8235394 1.00 TRPA1 (0.70) TRPA1RIPK1TAAR1AOC3KDM4E
SCHEMBL8155333 0.87 TRPA1 (0.56) TRPA1RIPK1
SCHEMBL624310 0.86 TRPA1 (0.60) TRPA1RIPK1TAAR1AOC3KDM4E
SCHEMBL30148108 0.86 TRPA1 (0.60) TRPA1RIPK1TAAR1AOC3KDM4E
SCHEMBL6280516 0.85 RIPK1 (0.67) TRPA1RIPK1TAAR1AOC3
SCHEMBL1144321 0.85 TRPA1 (0.58) TRPA1RIPK1TAAR1AOC3ALDH1A1
SCHEMBL21778163 0.84 TRPA1 (0.53) TRPA1RIPK1KDM4ELMNA
SCHEMBL29263718 0.83 TRPA1 (0.56) TRPA1RIPK1TAAR1AOC3ALDH1A1
SCHEMBL16702621 0.83 TRPA1 (1.00) TRPA1RIPK1TAAR1AOC3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-3883524-A1 MULTIFUNCTIONAL AROMATIC ALCOHOLS FOR PERSONAL CARE, HOME CARE AND INDUSTRIAL AND INSTITUTIONAL COMPOSITIONS Emerald Kalama Chemical, LLC (US) 2021-09-29 EP claimed
US-20210292680-A1 MULTIFUNCTIONAL AROMATIC ALCOHOLS FOR PERSONAL CARE, HOME CARE AND INDUSTRIAL AND INSTITUTIONAL COMPOSITIONS LANXESS CORPORATION 2021-09-23 US claimed
EP-3843869-A1 STERILE CHROMATOGRAPHY RESIN AND USE THEREOF IN MANUFACTURING PROCESSES Genzyme Corporation (US) 2021-07-07 EP claimed
CN-112638488-A Sterilized chromatography resin and use thereof in manufacturing process 建新公司 2021-04-09 CN claimed
CN-111393272-A Synthetic method of 3' -methyl propiophenone 惠泽化学科技(濮阳)有限公司 2020-07-10 CN claimed
US-20200069822-A1 STERILE CHROMATOGRAPHY RESIN AND USE THEREOF IN MANUFACTURING PROCESSES GENZYME CORPORATION (US) 2020-03-05 US claimed
WO-2020046602-A1 STERILE CHROMATOGRAPHY RESIN AND USE THEREOF IN MANUFACTURING PROCESSES GENZYME CORPORATION (US) 2020-03-05 WO claimed
CN-110144139-A A kind of zinc oxide base nano particle ink and photoelectric device 纳晶科技股份有限公司 2019-08-20 CN claimed
EP-2629889-B1 RUTHENIUM COMPLEXES AND THEIR USES IN PROCESSES FOR FORMATION AND/OR HYDROGENATION OF ESTERS, AMIDES AND DERIVATIVES THEREOF YEDA RES & DEV (IL) 2019-04-03 EP claimed
EP-2316025-A1 MEANS FOR THE DETECTION AND TREATMENT OF PROSTATE CELLS Eberhard-Karls-Universität Tübingen Universitätsklinikum (DE) 2011-05-04 EP claimed
WO-2010017986-A1 MEANS FOR THE DETECTION AND TREATMENT OF PROSTATE CELLS Eberhard-Karls-Universität Tübingen Universitätsklinikum (DE) 2010-02-18 WO claimed
US-6989052-B1 Phase change ink printing process XEROX CORPORATION (US) 2006-01-24 US claimed
US-20060004123-A1 PHASE CHANGE INK PRINTING PROCESS XEROX CORPORATION 2006-01-05 US claimed
CN-1635181-A Airplane cleaning agent CHANGSHA AISEN EQUIPMENT MAINT (CN) 2005-07-06 CN claimed
EP-0946699-B1 DRYER-ACTIVATED FABRIC CONDITIONING AND ANTISTATIC COMPOSITIONS WITH IMPROVED PERFUME LONGEVITY PROCTER & GAMBLE (US) 2003-10-15 EP claimed
EP-0918835-B1 RINSE ADDED FABRIC SOFTENING COMPOSITIONS AND METHOD OF USE FOR THE DELIVERY OF FRAGRANCE PRECURSORS PROCTER & GAMBLE (US) 2002-01-16 EP claimed
US-5830835-A FABRIC SOFTENER, PERFUME ESTER MIXTURES PROCTER & GAMBLE COMPANY (US) 1998-11-03 US claimed
US-5668102-A SOLID OR LIQUID COMPOSITION CONTAINING CATIONIC QUATERNARY AMMONIUM FABRIC SOFTENING COMPOUND, NONIONIC OR ANIONIC ESTER OF NON-ALLYLIC ALCOHOL PERFUME THE PROCTER & GAMBLE COMPANY (US) 1997-09-16 US claimed
US-4446161-A Aromatic, monohydric alcohols as preservatives for foods GENERAL FOODS CORPORATION (US) 1984-05-01 US 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-20210292680-A1 MULTIFUNCTIONAL AROMATIC ALCOHOLS FOR PERSONAL CARE, HOME CARE AND INDUSTRIAL AND INSTITUTIONAL COMPOSITIONS PAH, TYR, EP300 TRPA1 556/4885RIPK1 4036/4885TAAR1 531/4885

“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.