SCHEMBL2945866

SCHEMBL2945866

CC/C=C\CC(O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL8989778 1.00
SCHEMBL7132192 1.00
SCHEMBL31189055 0.92 ALDH1A1 (0.41)
SCHEMBL30350920 0.81 GRIK1 (0.39)
SCHEMBL26093414 0.81 GRIK1 (0.39)
SCHEMBL1658878 0.79
SCHEMBL6472297 0.79 TSHR (0.42)
SCHEMBL1658879 0.79
SCHEMBL6472293 0.79 TSHR (0.42)
SCHEMBL1784155 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5620879-A Process for producing natural cis-3-hexenol from unsaturated fatty acids RICARD, PERNOD (FR) 1997-04-15 US claimed
EP-3116598-A1 DETERGENT COMPOSITION The Procter & Gamble Company (US) 2017-01-18 EP disclosed
EP-3089730-A1 DEODORANT COMPOSITIONS HAVING ANTIBACTERIAL AND ODOR BLOCKING PROPERTIES AND RELATED METHODS The Dial Corporation (US) 2016-11-09 EP disclosed
US-9381142-B2 Olfactory adaptation and cross-adapting agents to reduce the perception of body odors MONELL CHEMICAL SENSES CENTER (US) 2016-07-05 US disclosed
WO-2015138576-A1 DETERGENT COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2015-09-17 WO disclosed
WO-2015102915-A1 DEODORANT COMPOSITIONS HAVING ANTIBACTERIAL AND ODOR BLOCKING PROPERTIES AND RELATED METHODS THE DIAL CORPORATION (US) 2015-07-09 WO disclosed
US-20150182436-A1 DEODORANT COMPOSITIONS HAVING ANTIBACTERIAL AND ODOR BLOCKING PROPERTIES AND METHODS FOR USING THE SAME THE DIAL CORPORATION 2015-07-02 US disclosed
EP-2581077-A2 Olfactory adaption and cross-adapting agents to reduce the perception of body odors Symrise AG (DE) 2013-04-17 EP disclosed
US-20100254927-A1 OLFACTORY ADAPTATION AND CROSS-ADAPTING AGENTS TO REDUCE THE PERCEPTION OF BODY ODORS MONELL CHEMICAL SENSES CENTER (US) 2010-10-07 US disclosed
US-7763238-B2 Olfactory adaptation and cross-adapting agents to reduce the perception of body odors MONELL CHEMICAL SENSES CENTER (US) 2010-07-27 US disclosed
US-4348416-A FOODS, BEVERAGES, DENTIFRICES, CHEWING GUM INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-09-07 US disclosed
US-4341646-A 1-Ethoxy-1-ethanol acetate and uses thereof for augmenting or enhancing the aroma of taste of consumable materials INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-07-27 US disclosed
US-4339341-A Process for augmenting or enhancing the aroma of a detergent using 1-ethoxy-1-ethanol acetate INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-07-13 US disclosed
US-4333481-A 1-n-Butoxy-1-ethanol acetate and uses thereof for augmenting or enhancing the aroma or taste of consumable materials INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-06-08 US disclosed
US-4331571-A 1-N-Butoxy-1-ethanol acetate useful for augmenting or enhancing the aroma of perfume materials INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-05-25 US disclosed
US-4330417-A 1-N-Butoxy-1-ethanol acetate and uses thereof for augmenting or enhancing the aroma or taste of consumable materials INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-05-18 US disclosed
EP-0048545-A2 1-Ethoxy ethyl acetate and uses thereof for augmenting or enhancing the aroma or taste of consumable materials INTERNATIONAL FLAVORS &amp; FRAGRANCES INC. (US) 1982-03-31 EP disclosed
EP-0046072-A2 Use of 1-ethoxyethyl acetate for augmenting or enhancing the aroma or taste of consumable materials INTERNATIONAL FLAVORS &amp; FRAGRANCES INC. (US) 1982-02-17 EP disclosed
US-4296137-A FOODS, CHEWING GUM INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1981-10-20 US disclosed
US-4296138-A FOR FOOD, CHEWING GUM INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1981-10-20 US disclosed