⚠ 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 | |
|---|---|---|---|---|
| Ether SCHEMBL63245 | 0.78 | — | — | |
| Ether SCHEMBL3758739 | 0.78 | ALDH1A1 (0.40) | — | |
| Ether SCHEMBL9737355 | 0.75 | ALDH1A1 (0.38) | — | |
| Ether SCHEMBL11418162 | 0.75 | ALDH1A1 (0.38) | — | |
| Ether SCHEMBL27326727 | 0.71 | ALDH1A1 (0.35) | — | |
| SCHEMBL14063543 | 0.71 | — | — | |
| SCHEMBL14676021 | 0.69 | — | — | |
| SCHEMBL28846957 | 0.69 | — | — | |
| SCHEMBL15789649 | 0.69 | ALDH1A1 (0.33) | — | |
| Phosphonic Acid SCHEMBL28969654 | 0.69 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0783504-B1 | [1,2,4]TRIAZOLO[4,3-a]QUINOXALINONE DERIVATIVES, THEIR PREPARATION AND USE AS ANTAGONISTS OF AMPA-RECEPTORS | NOVO NORDISK AS (DK) | 2000-03-15 | — | — | EP | claimed |
| CN-112218913-A | Porous body and method for producing porous body | 株式会社伊玛尔斯京都 | 2021-01-12 | — | — | CN | disclosed |
| EP-0783504-B1 | [1,2,4]TRIAZOLO[4,3-a]QUINOXALINONE DERIVATIVES, THEIR PREPARATION AND USE AS ANTAGONISTS OF AMPA-RECEPTORS | NOVO NORDISK AS (DK) | 2000-03-15 | — | — | EP | disclosed |