⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1617888 | 1.00 | — | — | |
| SCHEMBL294271 | 1.00 | — | — | |
| SCHEMBL17920784 | 0.75 | — | — | |
| SCHEMBL7927909 | 0.75 | — | — | |
| SCHEMBL7037463 | 0.69 | — | — | |
| SCHEMBL3192126 | 0.68 | SOAT2 (0.30) | — | |
| SCHEMBL18061246 | 0.67 | — | — | |
| SCHEMBL8375627 | 0.67 | — | — | |
| SCHEMBL4296930 | 0.67 | — | — | |
| SCHEMBL11424708 | 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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117105741-A | Method for photocatalytic isomerization of alkine alcohol | 浙江新和成药业有限公司 | 2023-11-24 | — | — | CN | claimed |
| CN-116969812-A | Process for the metathesis isomerization of photocatalytic isohexide | 浙江新和成股份有限公司 | 2023-10-31 | — | — | CN | claimed |
| EP-2225193-B1 | PHOTOCHEMICAL ISOMERIZATION OF A PENT-2-EN-4-YN-1-OL | DSM IP ASSETS BV (NL) | 2014-02-26 | — | — | EP | claimed |
| EP-2225193-A2 | PHOTOCHEMICAL ISOMERIZATION OF A PENT-2-EN-4-YN-1-OL | DSM IP Assets B.V. (NL) | 2010-09-08 | — | — | EP | claimed |
| WO-2009080280-A2 | PHOTOCHEMICAL ISOMERIZATION OF A PENT-2-EN-4-YN-1-OL | DSM IP ASSETS B.V. (NL) | 2009-07-02 | — | — | WO | claimed |
| CN-116969812-B | Process for the metathesis isomerization of photocatalytic isohexide | 浙江新和成股份有限公司 | 2026-02-10 | — | — | CN | disclosed |
| CN-117105741-A | Method for photocatalytic isomerization of alkine alcohol | 浙江新和成药业有限公司 | 2023-11-24 | — | — | CN | disclosed |
| US-20160032257-A1 | AGENT AND METHOD FOR MODIFYING THE 5' CAP OF RNA | UNIVERSITAET HAMBURG (DE) | 2016-02-04 | — | — | US | disclosed |
| EP-2225193-B1 | PHOTOCHEMICAL ISOMERIZATION OF A PENT-2-EN-4-YN-1-OL | DSM IP ASSETS BV (NL) | 2014-02-26 | — | — | EP | disclosed |
| CN-101903319-B | Photochemical isomerization of a pent-2-en-4-yn-1-ol | DSM IP ASSETS BV | 2014-01-15 | — | — | CN | disclosed |
| CN-101903319-A | Photochemical isomerization of a pent-2-en-4-yn-1-ol | DSM IP ASSETS BV | 2010-12-01 | — | — | CN | disclosed |
| EP-2225193-A2 | PHOTOCHEMICAL ISOMERIZATION OF A PENT-2-EN-4-YN-1-OL | DSM IP Assets B.V. (NL) | 2010-09-08 | — | — | EP | disclosed |
| EP-2225193-A2 | PHOTOCHEMICAL ISOMERIZATION OF A PENT-2-EN-4-YN-1-OL | DSM IP Assets B.V. (NL) | 2010-09-08 | — | — | EP | disclosed |
| WO-2009080280-A3 | PHOTOCHEMICAL ISOMERIZATION OF A PENT-2-EN-4-YN-1-OL | DSM IP ASSETS B.V. (NL) | 2009-08-27 | — | — | WO | disclosed |
| WO-2009080280-A2 | PHOTOCHEMICAL ISOMERIZATION OF A PENT-2-EN-4-YN-1-OL | DSM IP ASSETS B.V. (NL) | 2009-07-02 | — | — | WO | disclosed |
| WO-2009080280-A2 | PHOTOCHEMICAL ISOMERIZATION OF A PENT-2-EN-4-YN-1-OL | DSM IP ASSETS B.V. (NL) | 2009-07-02 | — | — | WO | disclosed |