SCHEMBL4400514

SCHEMBL4400514

CC=CCCC(=O)CC

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
SCHEMBL4582063 1.00
SCHEMBL726218 0.95 TDP1 (0.41)
SCHEMBL726217 0.95 TDP1 (0.41)
SCHEMBL9389879 0.95 TDP1 (0.41)
SCHEMBL9389884 0.95 TDP1 (0.41)
SCHEMBL572041 0.88 TDP1 (0.39)
SCHEMBL572040 0.88 TDP1 (0.39)
SCHEMBL16346691 0.87 TOP1 (0.48)
SCHEMBL16346692 0.87 TOP1 (0.48)
SCHEMBL7998543 0.86 MAPT (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119023832-A Use of metabolic markers for the preparation of products for monitoring psoriasis and products thereof 中日友好医院(中日友好临床医学研究所) 2024-11-26 CN claimed
EP-3383359-B1 A FRAGRANCE COMPOSITION SYMRISE AG (DE) 2022-08-03 EP claimed
CN-101393178-A Fermentation beef ham identification method INST OF ANIMAL SCIENCES CAAS (CN) 2009-03-25 CN claimed
EP-0302436-A2 Metal-diketone absorbents for carbon monoxide or olefins AIR PRODUCTS AND CHEMICALS, INC. (US) 1989-02-08 EP claimed
US-4001249-A CYCLOCOUPLING N-ACYLPYRROLE AND A,A*-HALOGENOKETONE, REDUCING AGENTS SANWA KAGAKU KENKYUSHO CO. LTD. (JA) 1977-01-04 US claimed
WO-2025262285-A1 PU BASED ON POLYOLS CONTAINING CLEAVABLE BONDS BASF SE (DE) 2025-12-26 WO disclosed
US-20250235136-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2025-07-24 US disclosed
US-12336820-B2 Methods of preparing/optimizing perfume compositions GIVAUDAN SA (CH) 2025-06-24 US disclosed
CN-119534683-A Identification method of volatile biomarker of kiwi fruit soft rot and identification method of soft rot 陕西师范大学 2025-02-28 CN disclosed
CN-118176179-A Novel spiro compounds 田边三菱制药株式会社 2024-06-11 CN disclosed
EP-4373308-A1 AEROSOL GENERATION Nicoventures Trading Limited (GB) 2024-05-29 EP disclosed
US-20240016190-A1 ROXBURGH ROSE AND COIX SEEDS COMPOSITE BEVERAGE AND PREPARATION METHOD THEREOF GUIZHOU UNIVERSITY (CN) 2024-01-18 US disclosed
EP-1284949-A2 SYNTHESIS AND ISOLATION OF METAL ALKOXIDES Mine Safety Appliances Company (US) 2003-02-26 EP disclosed
WO-2002076516-A1 UTILIZATION OF ODORIFEROUS COMPOSITIONS IN ODORIFEROUS CHIPS SYMRISE GMBH & CO. KG (DE) 2002-10-03 WO disclosed
WO-2001092191-A2 SYNTHESIS AND ISOLATION OF METAL ALKOXIDES MINE SAFETY APPLIANCES COMPANY (US) 2001-12-06 WO disclosed
US-5795750-A Process for the continuous enzymatic extraction of hydrophobic products and device suitable therefor FORSCHUNGZENTRUM JULICH GMBH (DE) 1998-08-18 US disclosed
WO-1994012457-A1 PROCESS FOR PREPARING TERTIARY ALKYNOLS LOYOLA UNIVERSITY OF CHICAGO (US) 1994-06-09 WO disclosed
EP-0302436-A2 Metal-diketone absorbents for carbon monoxide or olefins AIR PRODUCTS AND CHEMICALS, INC. (US) 1989-02-08 EP disclosed
US-3984478-A TREATING AN UNSATURATED COMPOUND WITH CARBON MONOXIDE IN A HETEROGENEOUS CATALYST UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-10-05 US disclosed
US-3959464-A Microencapsulated methyl and ethyl parathion insecticide in aqueous carrier PENNWALT CORPORATION (US) 1976-05-25 US disclosed