SCHEMBL160885

SCHEMBL160885

CC1CC(=O)C(=O)O1

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
SCHEMBL20972837 0.76
SCHEMBL8014755 0.74
SCHEMBL311139 0.74
SCHEMBL374192 0.73
SCHEMBL432483 0.73
SCHEMBL35509 0.73
SCHEMBL20245635 0.72 SMN1; SMN2 (0.50)
SCHEMBL23621134 0.71 SMN1; SMN2 (0.94)
SCHEMBL22001696 0.71 SMN1; SMN2 (0.94)
SCHEMBL20582013 0.71 SMN1; SMN2 (0.94)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107098807-B Fermentation pathways for the production of levulinic acid, levulinic acid esters, valerolactone, and derivatives thereof 阿泽达公司 2020-07-10 CN claimed
US-10246727-B2 Fermentation route for the production of levulinic acid, levulinate esters and valerolactone and derivatives thereof ARZEDA CORP. (US) 2019-04-02 US claimed
US-20170275657-A1 FERMENTATION ROUTE FOR THE PRODUCTION OF LEVULINIC ACID, LEVULINATE ESTERS AND VALEROLACTONE AND DERIVATIVES THEREOF ARZEDA CORP. 2017-09-28 US claimed
CN-107098807-B Fermentation pathways for the production of levulinic acid, levulinic acid esters, valerolactone, and derivatives thereof 阿泽达公司 2020-07-10 CN disclosed
US-10246727-B2 Fermentation route for the production of levulinic acid, levulinate esters and valerolactone and derivatives thereof ARZEDA CORP. (US) 2019-04-02 US disclosed
US-20170275657-A1 FERMENTATION ROUTE FOR THE PRODUCTION OF LEVULINIC ACID, LEVULINATE ESTERS AND VALEROLACTONE AND DERIVATIVES THEREOF ARZEDA CORP. 2017-09-28 US disclosed
US-20170275657-A1 FERMENTATION ROUTE FOR THE PRODUCTION OF LEVULINIC ACID, LEVULINATE ESTERS AND VALEROLACTONE AND DERIVATIVES THEREOF ARZEDA CORP. 2017-09-28 US disclosed
US-9523105-B2 Fermentation route for the production of levulinic acid, levulinate esters and valerolactone and derivatives thereof ARZEDA CORPORATION (US) 2016-12-20 US disclosed
CN-103180279-B Fermentation pathways for the production of levulinic acid, levulinic acid esters, valerolactone, and derivatives thereof ARZEDA CORP. (US) 2016-12-14 CN disclosed
US-9347066-B2 Plants and seeds with altered storage compound levels, related constructs and methods involving genes encoding proteins with similarity to bacterial 2,4-dihydroxy-hept-2-ene-1,7-dioic acid class II-like aldolase proteins CORTEVA AGRISCIENCE LLC 2016-05-24 US disclosed
US-20130330779-A1 FERMENTATION ROUTE FOR THE PRODUCTION OF LEVULINIC ACID, LEVULINATE ESTERS AND VALEROLACTONE AND DERIVATIVES THEREOF ARZEDA CORPORATION 2013-12-12 US disclosed
US-8535769-B2 Polymerizable liquid crystal compound, polymerizable liquid crystal composition, and oriented film NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-09-17 US disclosed
EP-2611764-A1 FERMENTATION ROUTE FOR THE PRODUCTION OF LEVULINIC ACID, LEVULINATE ESTERS, VALEROLACTONE, AND DERIVATIVES THEREOF Arzeda Corp. (US) 2013-07-10 EP disclosed
CN-103180279-A Fermentation pathways for the production of levulinic acid, levulinic acid esters, valerolactone, and derivatives thereof ARZEDA CORP 2013-06-26 CN disclosed
US-20130111633-A1 PLANTS AND SEEDS WITH ALTERED STORAGE COMPOUND LEVELS, RELATED CONSTRUCTS AND METHODS INVOLVING GENES ENCODING PROTEINS WITH SIMILARITY TO BACTERIAL 2,4-DIHYDROXY-HEPT-2-ENE-1,7-DIOIC ACID CLASS II-LIKE ALDOLASE PROTEINS E.I. DU PONT DE NEMOOURS AND COMPANY (US) 2013-05-02 US disclosed
EP-2494043-A2 PLANTS AND SEEDS WITH ALTERED STORAGE COMPOUND LEVELS, RELATED CONSTRUCTS AND METHODS INVOLVING GENES ENCODING PROTEINS WITH SIMILARITY TO BACTERIAL 2,4-DIHYDROXY-HEPT-2-ENE-1,7-DIOIC ACID CLASS II-LIKE ALDOLASE PROTEINS E. I. du Pont de Nemours and Company (US) 2012-09-05 EP disclosed
US-20120172560-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, AND ORIENTED FILM NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-07-05 US disclosed
US-20120172560-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, AND ORIENTED FILM NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-07-05 US disclosed
WO-2012030860-A1 FERMENTATION ROUTE FOR THE PRODUCTION OF LEVULINIC ACID, LEVULINATE ESTERS, VALEROLACTONE, AND DERIVATIVES THEREOF ARZEDA CORP. (US) 2012-03-08 WO disclosed
WO-2011053898-A2 PLANTS AND SEEDS WITH ALTERED STORAGE COMPOUND LEVELS, RELATED CONSTRUCTS AND METHODS INVOLVING GENES ENCODING PROTEINS WITH SIMILARITY TO BACTERIAL 2,4-DIHYDROXY-HEPT-2-ENE-1,7-DIOIC ACID CLASS II-LIKE ALDOLASE PROTEINS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-05-05 WO disclosed