SCHEMBL320740

SCHEMBL320740

CC(=O)C=CC(C)C

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
SCHEMBL320739 1.00
SCHEMBL10680124 1.00
Hydrochloric Acid SCHEMBL9142316 0.94 GABRP (0.39)
Hydrochloric Acid SCHEMBL9142312 0.94 GABRP (0.39)
SCHEMBL9142322 0.89 GABRP (0.36)
SCHEMBL21610111 0.82
SCHEMBL751359 0.79
SCHEMBL18392864 0.79
SCHEMBL1781514 0.79
SCHEMBL1781516 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 491 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4444108-B1 ALDEHYDE MIXTURES FOR FLAVOUR IMPROVEMENT SYMRISE AG (DE) 2025-09-10 EP claimed
CN-120155185-A Application of non-noble metal supported catalyst in catalytic hydrogenation reaction and method for catalyzing hydrogenation of 5-methyl-3-hexene-2-ketone to obtain methyl isoamyl ketone by using non-noble metal supported catalyst 青岛科技大学 2025-06-17 CN claimed
CN-119924491-A Flavoring composition with balanced taste characteristics 西姆莱斯有限公司 2025-05-06 CN claimed
EP-4444108-A1 ALDEHYDE MIXTURES FOR FLAVOUR IMPROVEMENT Symrise AG (DE) 2024-10-16 EP claimed
US-20240245085-A1 FLAVORING COMPOSITIONS FOR TASTE IMPROVEMENT SYMRISE AG (DE) 2024-07-25 US claimed
CN-118338791-A Aldehyde mixtures for improved flavor 西姆莱斯有限公司 2024-07-12 CN claimed
CN-117529238-A Flavoring composition for taste improvement 西姆莱斯有限公司 2024-02-06 CN claimed
EP-4161293-B1 FLAVOURING COMPOSITION WITH BALANCED TASTE PROFILE SYMRISE AG (DE) 2024-01-31 EP claimed
EP-4161291-B1 FLAVORING COMPOSITIONS FOR TASTE IMPROVEMENT SYMRISE AG (DE) 2023-11-01 EP claimed
CN-116437815-A Flavoring composition with balanced taste characteristics 西姆莱斯有限公司 2023-07-14 CN claimed
WO-2010015607-A2 METHOD OF EVALUATING ORAL CANCER RISK IN HUMAN INSTITUT CLINIDENT (FR) 2010-02-11 WO claimed
EP-1337229-B1 IMMOBILISATION OF ACTIVE AGENTS ON FIBRES HENKEL AG & CO KGAA (DE) 2009-09-30 EP claimed
EP-1996145-A2 REDUCTIVE COLOUR REMOVAL Henkel AG & Co. KGaA (DE) 2008-12-03 EP claimed
WO-2007107310-A2 REDUCTIVE COLOUR REMOVAL HENKEL AG & CO. KGAA (DE) 2007-09-27 WO claimed
US-6960694-B2 Processes for preparing β-hydroxy-ketones and α,β-unsaturated ketones EASTMAN CHEMICAL COMPANY (US) 2005-11-01 US claimed
US-20050004401-A1 Processes for preparing beta-hydroxy-ketones and alpha,beta-unsaturated ketones EASTMAN CHEMICAL COMPANY 2005-01-06 US claimed
EP-1337229-A2 IMMOBILISATION OF ACTIVE AGENTS ON FIBRES Henkel Kommanditgesellschaft auf Aktien (DE) 2003-08-27 EP claimed
WO-2002043675-A2 IMMOBILISATION OF ACTIVE AGENTS ON FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2002-06-06 WO claimed
EP-0792862-B1 Process for obtaining beta hydroxy and/or alpha-beta unsaturated carbonyl compounds ATOFINA (FR) 2001-03-21 EP claimed
US-5936131-A Process for obtaining β-hydroxy and/or α,β-unsaturated carbonyl compounds ELF ATOCHEM S,A (FR) 1999-08-10 US claimed