⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28306906 | 0.87 | — | — | |
| SCHEMBL16085970 | 0.87 | — | — | |
| SCHEMBL28063815 | 0.87 | — | — | |
| SCHEMBL217070 | 0.87 | — | — | |
| SCHEMBL23800905 | 0.75 | — | — | |
| SCHEMBL16085878 | 0.75 | — | — | |
| SCHEMBL16085968 | 0.75 | — | — | |
| SCHEMBL16085957 | 0.75 | — | — | |
| SCHEMBL1138537 | 0.75 | — | — | |
| SCHEMBL6402629 | 0.75 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103917509-B | Process for producing alkanediol | 宇部兴产株式会社 | 2016-08-31 | — | — | CN | disclosed |
| US-9051234-B2 | Method for producing alkanediol | UBE INDUSTRIES, LTD. (JP) | 2015-06-09 | — | — | US | disclosed |
| US-8940946-B2 | Method for producing high-purity 1,5-pentanediol | UBE INDUSTRIES, LTD. (JP) | 2015-01-27 | — | — | US | disclosed |
| US-20140316167-A1 | METHOD FOR PRODUCING ALKANEDIOL | UBE INDUSTRIES, LTD (JP) | 2014-10-23 | — | — | US | disclosed |
| US-20140309461-A1 | METHOD FOR PRODUCING HIGH-PURITY 1,5-PENTANEDIOL | UBE INDUSTRIES, LTD. (JP) | 2014-10-16 | — | — | US | disclosed |
| EP-2781499-A1 | METHOD FOR PRODUCING HIGH-PURITY 1,5-PENTANEDIOL | Ube Industries, Ltd. (JP) | 2014-09-24 | — | — | EP | disclosed |
| EP-2781498-A1 | METHOD FOR PRODUCING ALKANEDIOL | Ube Industries, Ltd. (JP) | 2014-09-24 | — | — | EP | disclosed |
| CN-103917509-A | Process for producing alkanediol | UBE INDUSTRIES | 2014-07-09 | — | — | CN | disclosed |
| CN-103906726-A | Process for producing high-purity 1, 5-pentanediol | UBE INDUSTRIES | 2014-07-02 | — | — | CN | disclosed |