Acetaldehyde

Acetaldehyde

SCHEMBL895439

CC=O.c1cc2cc-2c1

nearest known ligand 0.00

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⚠ 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
SCHEMBL9786399 0.84 CYP3A4 (0.46)
SCHEMBL27798276 0.84 MEN1 (0.46)
Formic Acid SCHEMBL3169782 0.81
Propene SCHEMBL14799996 0.81
SCHEMBL9776818 0.81
Propionaldehyde SCHEMBL7564236 0.80 ALDH1A1 (0.47)
Isobutyraldehyde SCHEMBL7089818 0.80 CYP3A4 (0.39)
SCHEMBL7196829 0.79
Ethane SCHEMBL28709478 0.79
SCHEMBL4969576 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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110769804-B Composition for improving smell 西姆莱斯股份公司 2024-01-05 CN disclosed
WO-2023186256-A1 FIREPROOFING AGENTS SYMRISE AG (DE) 2023-10-05 WO disclosed
WO-2023186917-A1 FIREPROOFING AGENTS SYMRISE AG (DE) 2023-10-05 WO disclosed
US-11332692-B2 Composition for odour improvement SYMRISE AG (DE) 2022-05-17 US disclosed
US-11291234-B2 Food composition SYMRISE AG (DE) 2022-04-05 US disclosed
US-11219230-B2 Mixtures with stabilising properties SYMRISE AG (DE) 2022-01-11 US disclosed
US-11089797-B2 Process for producing flavoured food particles SYMRISE AG (DE) 2021-08-17 US disclosed
US-10993463-B2 Method for producing large agglomerate particles SYMRISE AG (DE) 2021-05-04 US disclosed
EP-3727010-A1 FOOD COMPOSITION Symrise AG (DE) 2020-10-28 EP disclosed
US-20200329750-A1 FOOD COMPOSITION SYMRISE AG (DE) 2020-10-22 US disclosed
EP-1937089-A1 MIXTURES HAVING A SALTY TASTE Symrise GmbH & Co. KG (DE) 2008-07-02 EP disclosed
WO-2007045566-A1 MIXTURES HAVING A SALTY TASTE SYMRISE GMBH & CO. KG (DE) 2007-04-26 WO disclosed
US-20060286237-A1 Use of divanillin as a flavouring agent SYMRISE GMBH & CO. KG (DE) 2006-12-21 US disclosed
CN-1758854-A Use of divanillin as a flavouring agent SYMRISE GMBH & CO KG (DE) 2006-04-12 CN disclosed
US-20060052627-A1 Novel modulators of the PPAR-type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2006-03-09 US disclosed
EP-1603408-A1 USE OF DIVANILLIN AS A FLAVOURING AGENT Symrise GmbH & Co. KG (DE) 2005-12-14 EP disclosed
EP-1596853-A1 COMPOUNDS WHICH ARE MODULATORS OF THE PPAR-TYPE RECEPTORS AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2005-11-23 EP disclosed
WO-2004078302-A1 USE OF DIVANILLIN AS A FLAVOURING AGENT SYMRISE GMBH & CO. KG (DE) 2004-09-16 WO disclosed
WO-2004071504-A1 COMPOUNDS WHICH ARE MODULATORS OF THE PPAR-TYPE RECEPTORS AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-08-26 WO disclosed
WO-2003092408-A1 EDIBLE FIXATIVES COMPRISED OF GELATING PROTEINS SYMRISE GMBH & CO. KG (DE) 2003-11-13 WO disclosed