SCHEMBL3989087

SCHEMBL3989087

COC(C=CC(OC)OC)OC

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
SCHEMBL1679775 1.00
SCHEMBL5696389 1.00
SCHEMBL12267693 0.86
SCHEMBL11065476 0.84
SCHEMBL11065473 0.84
SCHEMBL2992683 0.81
SCHEMBL2992678 0.81
SCHEMBL23852595 0.78
SCHEMBL762121 0.78
SCHEMBL16993637 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12516009-B2 Sustainable process for the manufacture of 1,1,4,4-tetramethoxy-2-butene DSM IP ASSETS B.V. (NL) 2026-01-06 US claimed
US-20230144339-A1 SUSTAINABLE PROCESS FOR THE MANUFACTURE OF 1,1,4,4-TETRAMETHOXY-2-BUTENE DSM IP ASSETS B.V. (NL) 2023-05-11 US claimed
EP-4110749-A1 SUSTAINABLE PROCESS FOR THE MANUFACTURE OF 1,1,4,4-TETRAMETHOXY-2-BUTENE DSM IP Assets B.V. (NL) 2023-01-04 EP claimed
CN-115135630-A Sustainable process for the manufacture of 1,1,4, 4-tetramethoxy-2-butene 帝斯曼知识产权资产管理有限公司 2022-09-30 CN claimed
CN-111943819-B Method for preparing deca-dialdehyde intermediate 万华化学集团股份有限公司 2022-09-20 CN claimed
CN-112125789-B Preparation method of 1, 8-alkoxy-1, 3,6, 8-tetramethoxy-2, 7-dimethyl-4-octene 万华化学集团股份有限公司 2022-09-20 CN claimed
CN-112121859-B Catalyst and preparation method thereof, and preparation method of 1,1,4, 4-tetramethoxy-2-butene 万华化学集团股份有限公司 2022-07-12 CN claimed
CN-110563561-B Preparation method of 1,1,4, 4-tetramethoxy-2-butene 万华化学集团股份有限公司 2022-04-22 CN claimed
CN-114214648-A Electrochemical synthesis method for preparing 1,1,4, 4-tetramethoxy-2-butene 万华化学集团股份有限公司 2022-03-22 CN claimed
CN-114044735-A Method for synthesizing tetra-acetal 万华化学集团股份有限公司 2022-02-15 CN claimed
CN-1958635-A Preparation method for water solution of phenol-formaldehyde resin JIANTAO FANYUNANSHAN PETROCHEM (CN) 2007-05-09 CN claimed
US-6673971-B2 REACTING 2,5-DIMETHOXYDIHYDROFURAN WITH METHANOL IN THE PRESENCE OF SOLID CATALYSTS HAVING ACIDIC CENTERS BASF AKTIENGESELLSCHAFT (DE) 2004-01-06 US claimed
EP-1099676-B1 Process for the preparation of 1,1,4,4-tetramethoxybutene-2 BASF AG (DE) 2003-10-29 EP claimed
CN-1099911-C Use of hydrogen-bis (oxalato) borate HOFFMANN LA ROCHE (CH) 2003-01-29 CN claimed
US-20020128520-A1 Preparation of 1,1,4,4 - tetramethoxy-2-butene WEGNER CHRISTOPH (DE) 2002-09-12 US claimed
US-6407291-B1 REACTING 2,5-DIMETHOXYFURAN WITH METHANOL IN PRESENCE OF SOLID ZEOLITE CATALYST BASF AKTIENGESELLSCHAFT (DE) 2002-06-18 US claimed
EP-1099676-A2 Process for the preparation of 1,1,4,4-tetramethoxybutene-2 BASF AKTIENGESELLSCHAFT (DE) 2001-05-16 EP claimed
US-5886196-A Method of catalyzing condensation reactions ROCHE VITAMINS INC. (US) 1999-03-23 US claimed
CN-1161251-A Use of hydrogen-bis (oxalato) borate HOFFMANN LA ROCHE (CH) 1997-10-08 CN claimed
EP-0784042-A1 Use of hydrogen bis(oxalato)borate F. HOFFMANN-LA ROCHE AG (CH) 1997-07-16 EP claimed