⚠ 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 | |
|---|---|---|---|---|
| Succinic Acid SCHEMBL356092 | 0.89 | TDP1 (0.41) | — | |
| SCHEMBL12863645 | 0.89 | ALDH1A1 (0.51) | — | |
| Fumaric Acid SCHEMBL4881929 | 0.88 | USP2 (0.44) | — | |
| SCHEMBL304203 | 0.87 | TDP1 (0.54) | — | |
| SCHEMBL13573118 | 0.85 | ALDH1A1 (0.49) | — | |
| SCHEMBL15385433 | 0.83 | P2RY10 (0.46) | — | |
| SCHEMBL8074473 | 0.82 | ALDH1A1 (0.58) | — | |
| SCHEMBL1525699 | 0.82 | ALDH1A1 (0.46) | — | |
| Alcohol SCHEMBL23675029 | 0.81 | LMNA (0.52) | — | |
| SCHEMBL14700391 | 0.81 | ALDH1A1 (0.45) | — |
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 103 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1322020-C | Polyester polyol, polyurethane using the same, and rigid polyurethane foam | KAWASAKI KASEI CHEMICALS CO LT (JP) | 2007-06-20 | — | — | CN | claimed |
| CN-1708529-A | Polyester polyol, polyurethane using the same, and rigid polyurethane foam | KAWASAKI KASEI CHEMICALS (JP) | 2005-12-14 | — | — | CN | claimed |
| EP-0885864-B1 | Process for purifying 1,4-butanediol by melt cristallisation | MITSUBISHI CHEM CORP (JP) | 2001-09-05 | — | — | EP | claimed |
| US-5981810-A | Process for preparing 1,4-butanediol | MITSUBISHI CHEMICAL CORPORATION (JP) | 1999-11-09 | — | — | US | claimed |
| EP-0885864-A1 | Process for purifying 1,4-butanediol by melt cristallisation | MITSUBISHI CHEMICAL CORPORATION (JP) | 1998-12-23 | — | — | EP | claimed |
| EP-0662529-A1 | Degreasing cleaner and method for cleaning oil-deposited material | Mitsubishi Chemical Corporation (JP) | 1995-07-12 | — | — | EP | claimed |
| EP-0102722-B1 | MODIFIED THERMOSETTING IMIDE RESINS | The Boots Company PLC (GB) | 1986-10-01 | — | — | EP | claimed |
| US-4596886-A | Plasticizer | MITSUBISHI MONSANTO CHEMICAL COMPANY (JP) | 1986-06-24 | — | — | US | claimed |
| JP-11100338-A | — | — | None | — | — | JP | disclosed |
| JP-11100337-A | — | — | None | — | — | JP | disclosed |
| JP-8060194-A | — | — | None | — | — | JP | disclosed |
| JP-59001527-A | — | — | None | — | — | JP | disclosed |
| CN-116672761-A | Capillary gas chromatography chiral separation column based on chiral metal organic macrocyclic material | 云南师范大学 | 2023-09-01 | — | — | CN | disclosed |
| US-20230161246-A1 | RESIST UNDERLAYER FILM-FORMING COMPOSITION | NISSAN CHEMICAL CORPORATION (JP) | 2023-05-25 | — | — | US | disclosed |
| EP-0322862-A2 | Optically active compounds, their preparation and their use in liquid crystal compositions and liquid crystal optical modulators | HITACHI, LTD. (JP) | 1989-07-05 | — | — | EP | disclosed |
| US-4681975-A | Polyester | MITSUBISHI MONSANTO CHEMICAL COMPANY (JP) | 1987-07-21 | — | — | US | disclosed |
| US-4596886-A | Plasticizer | MITSUBISHI MONSANTO CHEMICAL COMPANY (JP) | 1986-06-24 | — | — | US | disclosed |
| JP-S591527-A | PRODUCTION OF POLYESTER PLASTICIZER | MITSUBISHI MONSANTO CHEM CO | 1984-01-06 | — | — | JP | disclosed |
| US-4062900-A | OR BUTENEDIOLHYDROLYZING DIACETOXY-BUTANE OR BUTENE | MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JA) | 1977-12-13 | — | — | US | disclosed |
| US-4010197-A | Process for producing diacetoxybutanes and butanediols | MITSUBISHI CHEMICAL INDUSTRIES LTD. (JA) | 1977-03-01 | — | — | US | disclosed |