SCHEMBL2220877

SCHEMBL2220877

O=C(O)C1=COCC1

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
SCHEMBL484079 0.86
SCHEMBL6123254 0.84 OAT (0.38)
SCHEMBL12463565 0.80
Sulfuric Acid SCHEMBL1923285 0.79 OAT (0.35)
SCHEMBL4112454 0.76 CES2 (0.37)
SCHEMBL2143646 0.73 CES2 (0.35)
SCHEMBL15177067 0.73
SCHEMBL6384635 0.73 EPHX2 (0.36)
SCHEMBL6544924 0.73 PDPK1 (0.31)
SCHEMBL6544638 0.73 EPHX2 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8802678-B2 Carbonylated (aza) cyclohexanes as dopamine D3 receptor ligands BIOPROJET (FR) 2014-08-12 US claimed
US-20090286801-A1 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2009-11-19 US claimed
EP-2038268-A2 CARBONYLATED (AZA)CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2009-03-25 EP claimed
WO-2007148208-A2 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2007-12-27 WO claimed
EP-1092756-B1 Pigment compositions, method for production and use DEGUSSA (DE) 2004-07-07 EP claimed
EP-0962504-B1 Aqueous dispersions of carbon black DEGUSSA (DE) 2003-07-30 EP claimed
CN-119977916-A Synthesis method of dihydrofuran derivative 泰州职业技术学院 2025-05-13 CN disclosed
CN-112898196-B Potent soluble epoxide hydrolase inhibitors 艾科西斯有限责任公司 2024-12-27 CN disclosed
CN-115433194-A Synthetic method of hexahydro-3 aH-furan [2,3-c ] pyrrole-3 a-carboxylic acid methyl ester derivative 上海毕得医药科技股份有限公司 2022-12-06 CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
CN-112898196-A Potent soluble epoxide hydrolase inhibitors 艾科西斯有限责任公司 2021-06-04 CN disclosed
CN-110407776-B Preparation method of 3-aminomethyl tetrahydrofuran 石家庄手性化学有限公司 2021-04-02 CN disclosed
EP-3129023-B1 POTENT SOLUBLE EPOXIDE HYDROLASE INHIBITORS EICOSIS LLC (US) 2021-02-24 EP disclosed
WO-2003099274-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-12-04 WO disclosed
US-6569231-B1 Preparation can be used for coloring purposes and/or to provide antistatic characteristics in water-based coloring and lacquer systems, disperse dyes, printing inks, inking systems and coating systems DEGUSSA AG (DE) 2003-05-27 US disclosed
US-6569231-B1 Preparation can be used for coloring purposes and/or to provide antistatic characteristics in water-based coloring and lacquer systems, disperse dyes, printing inks, inking systems and coating systems DEGUSSA AG (DE) 2003-05-27 US disclosed
US-6503311-B1 Dispersions contain no wetting agent and contain at least one ozone-oxidized carbon black. The dispersions are produced by dispersing ozone-oxidized carbon black and other constituents in water. The dispersions may be used for the production of DEGUSSA AG (DE) 2003-01-07 US disclosed
EP-1250330-A1 PROCESS FOR THE PREPARATION OF 3-FUROATE ESTERS AND NOVEL INTERMEDIATE COMPOUNDS EASTMAN CHEMICAL COMPANY (US) 2002-10-23 EP disclosed
WO-2001055127-A1 PROCESS FOR THE PREPARATION OF 3-FUROATE ESTERS AND NOVEL INTERMEDIATE COMPOUNDS EASTMAN CHEMICAL COMPANY (US) 2001-08-02 WO disclosed
US-6184394-B1 ALKYL 3-FUROATES FROM 4-ACYL-2,3-DIHYDROFURANS FROM 4-ACYL-2,3-DIHYDRO-FURANS BY HALOGENATING IN THE PRESENCE OF AN ALKANOL FOLLOWED BY CONTACTING WITH A STRONG BASE; DRUGS; ANTINFLAMMATORY AND -FOULING AGENTS EASTMAN CHEMICAL COMPANY 2001-02-06 US disclosed