⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21872964 | 0.88 | FKBP5 (0.43) | — | |
| SCHEMBL5056719 | 0.88 | OR51E2 (0.39) | — | |
| Bromide SCHEMBL30513986 | 0.83 | FKBP5 (0.40) | — | |
| SCHEMBL8032768 | 0.82 | — | — | |
| SCHEMBL22908207 | 0.81 | — | — | |
| SCHEMBL20100268 | 0.77 | — | — | |
| SCHEMBL22908213 | 0.73 | — | — | |
| SCHEMBL8197272 | 0.72 | FKBP5 (0.36) | — | |
| SCHEMBL11720970 | 0.71 | CRBN (0.50) | — | |
| SCHEMBL2123999 | 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114573002-B | Mordenite molecular sieve and preparation method and application thereof | 中国科学院大连化学物理研究所 | 2023-06-30 | — | — | CN | claimed |
| CN-114573002-A | Mordenite molecular sieve and preparation method and application thereof | 中国科学院大连化学物理研究所 | 2022-06-03 | — | — | CN | claimed |
| CN-114573002-B | Mordenite molecular sieve and preparation method and application thereof | 中国科学院大连化学物理研究所 | 2023-06-30 | — | — | CN | disclosed |
| CN-114573002-A | Mordenite molecular sieve and preparation method and application thereof | 中国科学院大连化学物理研究所 | 2022-06-03 | — | — | CN | disclosed |
| WO-2019182015-A1 | ALGINIC ACID DERIVATIVE BONDED TO NONSTEROIDAL ANTI-INFLAMMATORY COMPOUND | 持田製薬株式会社 | 2019-09-26 | — | — | WO | disclosed |
| EP-1319668-A1 | Method for synthesis of (2S,3aS,7aS)-1-((S)-alanyl)-octahydro-1H-indole-2-carboxylic acid derivatives and use in the synthesis of perindopril | Les Laboratoires Servier (FR) | 2003-06-18 | — | — | EP | disclosed |