SCHEMBL848027

SCHEMBL848027

CCO[CH]COCC

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
SCHEMBL4216111 0.86 ALDH1A1 (0.38)
SCHEMBL363155 0.84 ALDH1A1 (0.36)
SCHEMBL11411993 0.80
SCHEMBL9000218 0.80
SCHEMBL27834907 0.78
SCHEMBL9550981 0.76
SCHEMBL6178304 0.76
SCHEMBL277199 0.76
SCHEMBL1286372 0.75
SCHEMBL20239692 0.73 THRB (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3218462-B1 DETERGENT AND CLEANING AGENTS HAVING IMPROVED PERFORMANCE HENKEL AG & CO KGAA (DE) 2020-03-04 EP claimed
EP-3218462-A1 DETERGENT AND CLEANING AGENTS HAVING IMPROVED PERFORMANCE Henkel AG & Co. KGaA (DE) 2017-09-20 EP claimed
US-20170240849-A1 DETERGENT AND CLEANING AGENTS HAVING IMPROVED PERFORMANCE HENKEL AG & CO. KGAA (DE) 2017-08-24 US claimed
WO-2016074936-A1 DETERGENT AND CLEANING AGENTS HAVING IMPROVED PERFORMANCE HENKEL AG & CO. KGAA (DE) 2016-05-19 WO claimed
CN-100339415-C Polymer guanidine derivatives as a cytostatic medicament GEOPHARMA PRODUKTIONSGMBH (AT) 2007-09-26 CN claimed
CN-1747984-A Polymer guanidine derivatives as a cytostatic medicament GEOPHARMA PRODUKTIONSGMBH (AT) 2006-03-15 CN claimed
EP-4170006-B1 CONCENTRATED FLOWABLE DETERGENT COMPOSITION WITH IMPROVED PROPERTIES HENKEL AG & CO KGAA (DE) 2024-06-05 EP disclosed
EP-4170005-B1 CONCENTRATED FLOWABLE DETERGENT COMPOSITION WITH IMPROVED PROPERTIES HENKEL AG & CO KGAA (DE) 2024-05-22 EP disclosed
EP-3864121-B1 LAUNDRY DETERGENT COMPOSITION COMPRISING A CATECHOL METAL COMPLEX COMPOUND HENKEL AG & CO KGAA (DE) 2023-11-29 EP disclosed
EP-4170006-A1 CONCENTRATED FLOWABLE DETERGENT COMPOSITION WITH IMPROVED PROPERTIES Henkel AG & Co. KGaA (DE) 2023-04-26 EP disclosed
EP-4170005-A1 CONCENTRATED FLOWABLE DETERGENT COMPOSITION WITH IMPROVED PROPERTIES Henkel AG & Co. KGaA (DE) 2023-04-26 EP disclosed
EP-3947615-B1 USE OF A MANNANASE ENZYME IN COMBINATION WITH CATECHOL DERIVATIVES HENKEL AG & CO KGAA (DE) 2023-04-05 EP disclosed
EP-3720835-B1 METHOD FOR PREPARING ETHERS OF CYCLOALIPHATIC OR ARALIPHATIC DIOLS BASF SE (DE) 2022-07-13 EP disclosed
US-4932997-A HERBICIDES CIBA-GEIGY CORPORATION (US) 1990-06-12 US disclosed
US-4875923-A HERBICIDE CIBA-GEIGY CORPORATION (US) 1989-10-24 US disclosed
EP-0258430-A1 NEMATIC LIQUID CRYSTAL PHASES MERCK PATENT GmbH (DE) 1988-03-09 EP disclosed
WO-1987005316-A1 NEMATIC LIQUID CRYSTAL PHASES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1987-09-11 WO disclosed
EP-0168043-A2 Liquid crystal phase MERCK PATENT GmbH (DE) 1986-01-15 EP disclosed
EP-0138006-A2 Liquid-crystal phase MERCK PATENT GmbH (DE) 1985-04-24 EP disclosed
US-4001306-A INHIBITION OF PLATELET AGGREGATION; NASAL PATENCY, LABOR INDUCEMENT, CONTROLLING BLOOD PRESSURE THE UPJOHN COMPANY (US) 1977-01-04 US disclosed