SCHEMBL401783

SCHEMBL401783

CSC(C)CC(C)=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
SCHEMBL1838165 0.85 ALDH1A1 (0.39)
SCHEMBL289798 0.78
SCHEMBL27555150 0.78
SCHEMBL2701354 0.76
SCHEMBL2964153 0.76
SCHEMBL19456035 0.74
SCHEMBL12173415 0.74
SCHEMBL12523375 0.74
SCHEMBL28684928 0.74 ALDH1A1 (0.48)
SCHEMBL28433170 0.74 ALDH1A1 (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117529238-A Flavoring composition for taste improvement 西姆莱斯有限公司 2024-02-06 CN claimed
CN-116437815-A Flavoring composition with balanced taste characteristics 西姆莱斯有限公司 2023-07-14 CN claimed
CN-101494999-A Method for using organic compound GIVAUDAN SA (CH) 2009-07-29 CN claimed
EP-4722328-A1 GRAPE WINE OR FRUIT WINE FERMENTATION NUTRITIONAL AGENT AND USE THEREOF Angel Yeast Co., Ltd (CN) 2026-04-08 EP disclosed
US-20240108040-A1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2024-04-04 US disclosed
CN-117529238-A Flavoring composition for taste improvement 西姆莱斯有限公司 2024-02-06 CN disclosed
US-11758933-B2 High intensity sweeteners FIRMENICH INCORPORATED (US) 2023-09-19 US disclosed
CN-116437815-A Flavoring composition with balanced taste characteristics 西姆莱斯有限公司 2023-07-14 CN disclosed
CN-112118741-B Method for increasing the content of thiol precursors in plants 丹斯塔发酵股份公司 2022-07-19 CN disclosed
EP-3368542-B1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2022-06-22 EP disclosed
US-11357246-B2 High intensity sweeteners FIRMENICH INCORPORATED (US) 2022-06-14 US disclosed
EP-2321270-B1 IMPROVED PROCESS FOR THE ADDITION OF THIOLATES TO ALFA, BETA-UNSATURATED CARBONYL OR SULFONYL COMPOUNDS DOW AGROSCIENCES LLC (US) 2016-03-23 EP disclosed
US-8101803-B2 Process for the addition of thiolates to α,β-unsaturated carbonyl or sulfonyl compounds DOW AGROSCIENCES LLC (US) 2012-01-24 US disclosed
US-8101803-B2 Process for the addition of thiolates to α,β-unsaturated carbonyl or sulfonyl compounds DOW AGROSCIENCES LLC (US) 2012-01-24 US disclosed
EP-2321270-A1 IMPROVED PROCESS FOR THE ADDITION OF THIOLATES TO ALFA, BETA-UNSATURATED CARBONYL OR SULFONYL COMPOUNDS Dow AgroSciences LLC (US) 2011-05-18 EP disclosed
WO-2010021855-A1 IMPROVED PROCESS FOR THE ADDITION OF THIOLATES TO ALFA, BETA-UNSATURATED CARBONYL OR SULFONYL COMPOUNDS DOW AGROSCIENCES LLC (US) 2010-02-25 WO disclosed
WO-2010021855-A1 IMPROVED PROCESS FOR THE ADDITION OF THIOLATES TO ALFA, BETA-UNSATURATED CARBONYL OR SULFONYL COMPOUNDS DOW AGROSCIENCES LLC (US) 2010-02-25 WO disclosed
US-20100048939-A1 PROCESS FOR THE ADDITION OF THIOLATES TO ?,?-UNSATURATED CARBONYL OR SULFONYL COMPOUNDS DOW AGROSCIENCES LLC (US) 2010-02-25 US disclosed
US-20100048939-A1 PROCESS FOR THE ADDITION OF THIOLATES TO ?,?-UNSATURATED CARBONYL OR SULFONYL COMPOUNDS DOW AGROSCIENCES LLC (US) 2010-02-25 US disclosed
CN-101494999-A Method for using organic compound GIVAUDAN SA (CH) 2009-07-29 CN disclosed