SCHEMBL451440

SCHEMBL451440

O=C1C=CC(=O)CC1

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
Methoxymethane SCHEMBL17203307 0.86 GSK3A (0.44)
SCHEMBL2600398 0.84
SCHEMBL17477579 0.84 ALDH1A1 (0.58)
SCHEMBL17477583 0.84 ALDH1A1 (0.58)
SCHEMBL17301151 0.81 ALDH1A1 (0.41)
SCHEMBL503827 0.80
SCHEMBL11311945 0.80
SCHEMBL133712 0.73
SCHEMBL277815 0.73
SCHEMBL6479874 0.72 ALDH1A1 (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 428 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210024453-A1 AMINATED LIGNIN-DERIVED COMPOUNDS AND USES THEREOF CMBLU PROJEKT AG (DE) 2021-01-28 US claimed
US-20100152407-A1 NOVEL COMPOUNDS LOCTITE (R&D) LIMITED (IE) 2010-06-17 US claimed
EP-1958199-A4 DEVICES AND PROCESSES FOR OPTICAL MEDIA KESTREL WIRELESS INC (US) 2009-07-08 EP claimed
US-20080204850-A1 Persistent Electro-Optic Devices and Processes for Optical Media NXP, B.V. (NL) 2008-08-28 US claimed
EP-1958199-A2 DEVICES AND PROCESSES FOR OPTICAL MEDIA Kestrel Wireless, Inc. (US) 2008-08-20 EP claimed
US-20080063828-A1 OPTICAL DISC DAXON TECHNOLOGY INC. (TW) 2008-03-13 US claimed
WO-2007016430-A2 DEVICES AND PROCESSES FOR OPTICAL MEDIA KESTREL WIRELESS INC. (US) 2007-02-08 WO claimed
EP-0916642-B1 Method for producing hydroquinone diester derivatives DAICEL CHEM (JP) 2003-05-21 EP claimed
EP-0984975-B1 MULTICYCLIC ERYTHROMYCIN DERIVATIVES ABBOTT LAB (US) 2003-04-23 EP claimed
US-6444841-B1 2002-09-03 US claimed
US-6444841-B2 REACTING A CYCLOHEX-2-ENE-1,4-DIONE DERIVATIVE IN THE PRESENCE OF AN ACID CATALYST WITH AN ACYLATING AGENT, E.G., ACETIC ANHYDRIDE; PURIFIED BY CRYSTALLIZATION TO CONTAIN ONLY 0-4% BY WEIGHT OF A CATECHOL DIESTER DERIVATIVE DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2002-09-03 US claimed
US-20020007082-A1 HYDROQUINONE DIESTER DERIVATIVES AND THE METHOD FOR PRODUCING THE SAME DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2002-01-17 US claimed
US-5922683-A ANTIBIOTICS TREATING BACTERIAL INFECTION ABBOTT LABORATORIES (US) 1999-07-13 US claimed
EP-0916642-A1 Hydroquinone diester derivatives and the method for producing the same Daicel Chemical Industries, Ltd. (JP) 1999-05-19 EP claimed
JP-55072144-A None JP disclosed
JP-11147881-A None JP disclosed
JP-11140019-A None JP disclosed
US-3994988-A CONTAINERS, SEPARATORS, MEDICAL EQUIPMENT BAXTER LABORATORIES, INC. (US) 1976-11-30 US disclosed
US-3981311-A Aromatic compositions FIRMENICH S.A. (CH) 1976-09-21 US disclosed
US-3937228-A Aromatic compositions FIRMENICH SA (CH) 1976-02-10 US disclosed