⚠ 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7822870 | 0.74 | — | — | |
| SCHEMBL31556324 | 0.74 | CYP3A4 (0.44) | — | |
| SCHEMBL5104539 | 0.74 | ALOX5 (0.42) | — | |
| SCHEMBL20217413 | 0.70 | — | — | |
| SCHEMBL27757242 | 0.70 | — | — | |
| SCHEMBL5101400 | 0.70 | — | — | |
| SCHEMBL6985553 | 0.70 | — | — | |
| SCHEMBL28483306 | 0.67 | CYP2A6 (0.40) | — | |
| SCHEMBL27503996 | 0.67 | IDO1 (0.34) | — | |
| SCHEMBL629035 | 0.67 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112010822-B | Method for preparing chiral gamma-amino alcohol and chiral alpha-allyl alcohol by one-pot method | 南方科技大学 | 2022-11-18 | — | — | CN | claimed |
| CN-113429249-B | Method for synthesizing chiral 4-hydroxy amino acid derivative | 陕西师范大学 | 2023-06-16 | — | — | CN | disclosed |
| CN-112010822-B | Method for preparing chiral gamma-amino alcohol and chiral alpha-allyl alcohol by one-pot method | 南方科技大学 | 2022-11-18 | — | — | CN | disclosed |
| CN-113429249-A | Method for synthesizing chiral 4-hydroxy amino acid derivative | 陕西师范大学 | 2021-09-24 | — | — | CN | disclosed |
| CN-108570141-B | Conjugated polymer containing alkylcarbonylbithiophene, and preparation method and application thereof | 华南理工大学 | 2021-05-14 | — | — | CN | disclosed |
| CN-112010822-A | Method for preparing chiral gamma-amino alcohol and chiral alpha-allyl alcohol by one-pot method | 南方科技大学 | 2020-12-01 | — | — | CN | disclosed |
| EP-2559720-A1 | CROSSLINKED COMPOSITION | Daicel Corporation (JP) | 2013-02-20 | — | — | EP | disclosed |
| US-20130026458-A1 | CROSSLINKABLE COMPOSITION | DAICEL CORPORATION (JP) | 2013-01-31 | — | — | US | disclosed |
| EP-1854791-B1 | NOVEL THIOPHENE COMPOUND AND PROCESS FOR PRODUCING CAFFENOFURAN OR ANALOGUE THEREOF FROM THE SAME | SAN EI GEN FFI INC (JP) | 2011-07-13 | — | — | EP | disclosed |
| US-7897790-B2 | synthetic intermediate that is useful for efficient production of kahweofuran; flavoring; when thiophene compound is reacted in hydrogen atmosphere using transition metal catalyst, cyclization occurs simultaneously with reduction, to produce a 2,3-dihydrothieno[2,3c]furan skeleton in a single step | SAN-EI GEN F.F.I., INC. (JP) | 2011-03-01 | — | — | US | disclosed |
| US-20080167481-A1 | Novel Thiophene Compound and Process for Producing Caffenofuran or Analogue Thereof from the Same | SAN EI GEN F.F.I., INC. (JP) | 2008-07-10 | — | — | US | disclosed |
| CN-101128450-A | New thiophene compound and method for producing kahweofuran or its analog using the same as raw material | SAN EI GEN FFI INC (JP) | 2008-02-20 | — | — | CN | disclosed |
| EP-1854791-A1 | NOVEL THIOPHENE COMPOUND AND PROCESS FOR PRODUCING CAFFENOFURAN OR ANALOGUE THEREOF FROM THE SAME | SAN-EI GEN F.F.I., INC. (JP) | 2007-11-14 | — | — | EP | disclosed |
| US-5185363-A | Administering for treatment of inflammatory diseases | ABBOTT LABORATORIES (US) | 1993-02-09 | — | — | US | disclosed |