SCHEMBL3397401

SCHEMBL3397401

CC(OC(C)(C)C(=O)O)C1CCCC(C)(C)C1

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
Propanol SCHEMBL29157894 0.92
SCHEMBL31482318 0.86
SCHEMBL31482314 0.86
SCHEMBL31482315 0.85
SCHEMBL31482313 0.82 CYP4F2 (0.33)
SCHEMBL1396737 0.82 CYP1A2 (0.31)
SCHEMBL27171592 0.81
SCHEMBL3748984 0.80
SCHEMBL3204871 0.80
SCHEMBL3207530 0.80 IDO1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12404479-B2 Laundry detergent composition containing graft copolymer and benefit agent THE PROCTER & GAMBLE COMPANY (US) 2025-09-02 US claimed
EP-4555060-A1 LAUNDRY DETERGENT COMPOSITION CONTAINING GRAFT COPOLYMER AND BENEFIT AGENT The Procter & Gamble Company (US) 2025-05-21 EP claimed
CN-119156438-A Perfume composition for sleep improvement 国际香料和香精公司 2024-12-17 CN claimed
WO-2024011345-A1 LAUNDRY DETERGENT COMPOSITION CONTAINING GRAFT COPOLYMER AND BENEFIT AGENT THE PROCTER & GAMBLE COMPANY (US) 2024-01-18 WO claimed
US-20240010954-A1 LAUNDRY DETERGENT COMPOSITION CONTAINING GRAFT COPOLYMER AND BENEFIT AGENT THE PROCTER & GAMBLE COMPANY 2024-01-11 US claimed
EP-2662434-B2 Use of specific compounds for enhancing odours SYMRISE AG (DE) 2023-08-16 EP claimed
US-10920170-B2 Fragrance mixtures containing tricyclo[5.2.1.0]-decane-8-ethyl ether SYMRISE AG (DE) 2021-02-16 US claimed
US-20200063063-A1 FRAGRANCE MIXTURES CONTAINING TRICYCLO[5.2.1.0]-DECANE-8-ETHYL ETHER SYMRISE AG (DE) 2020-02-27 US claimed
EP-2662098-B1 Use of specific compounds for changing odours SYMRISE AG (DE) 2018-10-24 EP claimed
EP-2662434-B1 Use of specific compounds for enhancing odours SYMRISE AG (DE) 2018-03-21 EP claimed
US-20140357547-A1 PROCESS FOR THE PREPARATION OF METHOXYMELONAL GIVAUDAN S.A. (CH) 2014-12-04 US claimed
US-8754028-B2 Perfume systems THE PROCTER & GAMBLE COMPANY (US) 2014-06-17 US claimed
US-20130303432-A1 Use Of Specific Compounds For Modifying Odors SYMRISE AG (DE) 2013-11-14 US claimed
EP-2662098-A1 Use of specific compounds for changing odours Symrise AG (DE) 2013-11-13 EP claimed
EP-2662434-A1 Use of specific compounds for enhancing odours Symrise AG (DE) 2013-11-13 EP claimed
US-20130172429-A1 FRAGRANCE MIXTURES CONTAINING CYCLOPENT-2-ENYL ETHYL ACETATE SYMRISE AG (DE) 2013-07-04 US claimed
WO-2013053102-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2013-04-18 WO claimed
EP-2474301-A1 Perfume mixtures containing Cyclopent-2-Enyl-ethyl acetate Symrise AG (DE) 2012-07-11 EP claimed
US-20100152083-A1 Perfume Systems PROCTER & GAMBLE COMPANY, THE 2010-06-17 US claimed
US-12404479-B2 Laundry detergent composition containing graft copolymer and benefit agent THE PROCTER & GAMBLE COMPANY (US) 2025-09-02 US disclosed
EP-4555060-A1 LAUNDRY DETERGENT COMPOSITION CONTAINING GRAFT COPOLYMER AND BENEFIT AGENT The Procter & Gamble Company (US) 2025-05-21 EP disclosed
CN-119156438-A Perfume composition for sleep improvement 国际香料和香精公司 2024-12-17 CN disclosed
CN-117836397-A Smell cancellation 奇华顿股份有限公司 2024-04-05 CN disclosed
CN-111836667-B Improvements in or relating to organic compounds 奇华顿股份有限公司 2024-02-23 CN disclosed
WO-2024015137-A1 LAUNDRY DETERGENT COMPOSITION CONTAINING TWO GRAFT COPOLYMER THE PROCTER & GAMBLE COMPANY (US) 2024-01-18 WO disclosed
WO-2024011345-A1 LAUNDRY DETERGENT COMPOSITION CONTAINING GRAFT COPOLYMER AND BENEFIT AGENT THE PROCTER & GAMBLE COMPANY (US) 2024-01-18 WO disclosed
US-20240018446-A1 LAUNDRY DETERGENT COMPOSITION CONTAINING TWO GRAFT COPOLYMER THE PROCTER & GAMBLE COMPANY 2024-01-18 US disclosed
CN-117384714-A Laundry detergent composition comprising two graft copolymers 宝洁公司 2024-01-12 CN disclosed
US-20240010954-A1 LAUNDRY DETERGENT COMPOSITION CONTAINING GRAFT COPOLYMER AND BENEFIT AGENT THE PROCTER & GAMBLE COMPANY 2024-01-11 US disclosed
US-11820960-B2 Compositions containing multiple populations of microcapsules THE PROCTER & GAMBLE COMPANY (US) 2023-11-21 US disclosed
US-11820961-B2 Musk compositions and methods of use thereof TAKASAGO INTERNATIONAL CORPORATION (JP) 2023-11-21 US disclosed
EP-2662434-B2 Use of specific compounds for enhancing odours SYMRISE AG (DE) 2023-08-16 EP disclosed
EP-3416612-B1 FRAGRANT MIXTURES CONTAINING ESTERS AND KETONES SYMRISE AG (DE) 2022-12-28 EP disclosed
US-20220220412-A1 MUSK COMPOSITIONS AND METHODS OF USE THEREOF TAKASAGO INTERNATIONAL CORPORATION (USA) (US) 2022-07-14 US disclosed
US-20210277328-A1 MUSK COMPOSITIONS AND METHODS OF USE THEREOF TAKASAGO INTERNATIONAL CORPORATION (JP) 2021-09-09 US disclosed
US-10988706-B2 Musk compositions and methods of use thereof TAKASAGO INTERNATIONAL CORPORATION (JP) 2021-04-27 US disclosed
US-10876067-B2 Fragrant mixtures containing esters and ketones SYMRISE AG (DE) 2020-12-29 US disclosed
US-20200332222-A1 MUSK COMPOSITIONS AND METHODS OF USE THEREOF TAKASAGO INTERNATIONAL CORPORATION (USA) (US) 2020-10-22 US disclosed
US-20190136148-A1 FRAGRANT MIXTURES CONTAINING ESTERS AND KETONES SYMRISE AG (DE) 2019-05-09 US disclosed
EP-2662098-B1 Use of specific compounds for changing odours SYMRISE AG (DE) 2018-10-24 EP disclosed
EP-2766333-B1 PROCESS FOR THE PREPARATION OF METHOXYMELONAL GIVAUDAN SA (CH) 2018-08-29 EP disclosed
EP-2662434-B1 Use of specific compounds for enhancing odours SYMRISE AG (DE) 2018-03-21 EP disclosed
US-9839931-B2 Dispensers for dispensing microcapsules THE PROCTER & GAMBLE COMPANY (US) 2017-12-12 US disclosed
US-9701606-B2 Process for the preparation of methoxymelonal GIVAUDAN S.A. (CH) 2017-07-11 US disclosed
US-20170065997-A1 Dispensers For Dispensing Microcapsules THE PROCTER & GAMBLE COMPANY 2017-03-09 US disclosed
US-20170065996-A1 Dispensers For Microcapsules PROCTER & GAMBLE (US) 2017-03-09 US disclosed
US-9579676-B1 Dispensers for microcapsules THE PROCTER & GAMBLE COMPANY (US) 2017-02-28 US disclosed
US-20160376524-A1 MUSK COMPOSITIONS AND METHODS OF USE THEREOF TAKASAGO INTERNATIONAL CORPORATION (USA) (US) 2016-12-29 US disclosed
US-20160376523-A1 MUSK COMPOSITIONS AND METHODS OF USE THEREOF TAKASAGO INTERNATIONAL CORPORATION (USA) (US) 2016-12-29 US disclosed
US-9340751-B2 Use of specific compounds for modifying odors SYMRISE AG (DE) 2016-05-17 US disclosed
EP-2366014-B1 PERFUME SYSTEMS PROCTER & GAMBLE (US) 2015-11-04 EP disclosed
US-8999913-B2 Fragrance mixtures containing cyclopent-2-enyl ethyl acetate SYMRISE AG (DE) 2015-04-07 US disclosed
US-20140357547-A1 PROCESS FOR THE PREPARATION OF METHOXYMELONAL GIVAUDAN S.A. (CH) 2014-12-04 US disclosed
US-20130303432-A1 Use Of Specific Compounds For Modifying Odors SYMRISE AG (DE) 2013-11-14 US disclosed
EP-2662434-A1 Use of specific compounds for enhancing odours Symrise AG (DE) 2013-11-13 EP disclosed
EP-2662098-A1 Use of specific compounds for changing odours Symrise AG (DE) 2013-11-13 EP disclosed
US-20130172429-A1 FRAGRANCE MIXTURES CONTAINING CYCLOPENT-2-ENYL ETHYL ACETATE SYMRISE AG (DE) 2013-07-04 US disclosed
WO-2013053102-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2013-04-18 WO disclosed
EP-2474301-A1 Perfume mixtures containing Cyclopent-2-Enyl-ethyl acetate Symrise AG (DE) 2012-07-11 EP disclosed
EP-2474301-A1 Perfume mixtures containing Cyclopent-2-Enyl-ethyl acetate Symrise AG (DE) 2012-07-11 EP disclosed