⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8119809 | 0.98 | — | — | |
| SCHEMBL3962219 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL28821719 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL4062543 | 0.95 | — | — | |
| SCHEMBL6527341 | 0.79 | KDM4E (0.32) | — | |
| SCHEMBL4804071 | 0.79 | EGLN2 (0.30) | — | |
| SCHEMBL27482372 | 0.79 | — | — | |
| SCHEMBL3070359 | 0.74 | NOTUM (0.33) | — | |
| SCHEMBL16964981 | 0.69 | — | — | |
| SCHEMBL977874 | 0.65 | ALDH1A1 (0.33) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118119631-A | Programmable selective acylation of polyols | 南洋理工大学 | 2024-05-31 | — | — | CN | claimed |
| CN-103502321-B | treating lignocellulosic materials | 英派尔科技开发有限公司 | 2017-05-10 | — | — | CN | disclosed |
| EP-2454263-A1 | 3-HYDROXYPYRROLIDINE INHIBITORS OF 5'-METHYLTHIOADENOSINE PHOSPHORYLASE AND NUCLEOSIDASE | The Albert Einstein College Of Medicine Of Yeshiva University (US) | 2012-05-23 | — | — | EP | disclosed |
| WO-2011008110-A1 | 3-HYDROXYPYRROLIDINE INHIBITORS OF 5'-METHYLTHIOADENOSINE PHOSPHORYLASE AND NUCLEOSIDASE | ALBERT EINSTEIN COLLEGE OF YESHIVA UNIVERSITY (US) | 2011-01-20 | — | — | WO | disclosed |
| EP-0561850-A1 | 7-SUBSTITUTED-6-FLUORO-1,4-DIHYDRO-4-OXO-QUINOLINE-3-CARBOXYLIC ACID COMPOUNDS USEFUL AS ANTIBACTERIAL AGENTS | SYNPHAR LABORATORIES INC. (CA) | 1993-09-29 | — | — | EP | disclosed |
| WO-1992010492-A1 | 7-SUBSTITUTED-6-FLUORO-1,4-DIHYDRO-4-OXO-QUINOLINE-3-CARBOXYLIC ACID COMPOUNDS USEFUL AS ANTIBACTERIAL AGENTS | SYNPHAR LABORATORIES, INC. (CA) | 1992-06-25 | — | — | WO | disclosed |