⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24499055 | 0.77 | — | — | |
| SCHEMBL1143907 | 0.76 | — | — | |
| SCHEMBL11136007 | 0.76 | TRPA1 (0.36) | — | |
| SCHEMBL3422366 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL3385836 | 0.75 | — | — | |
| SCHEMBL5793614 | 0.74 | LDHA (0.35) | — | |
| SCHEMBL2887477 | 0.74 | — | — | |
| SCHEMBL14974030 | 0.74 | — | — | |
| SCHEMBL892376 | 0.74 | — | — | |
| SCHEMBL67891 | 0.73 | ALDH1A1 (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10847651-B2 | Semiconductor devices including electrically conductive contacts and related systems and methods | MICRON TECHNOLOGY, INC. (US) | 2020-11-24 | — | — | US | disclosed |
| EP-1002123-A1 | ENZYMATIC KINETIC RESOLUTION OF AN INTERMEDIATE USEFUL FOR PREPARING SUBSTITUTED TRICYCLICS | SCHERING CORPORATION (US) | 2000-05-24 | — | — | EP | disclosed |
| WO-1998058073-A1 | ENZYMATIC KINETIC RESOLUTION OF AN INTERMEDIATE USEFUL FOR PREPARING SUBSTITUTED TRICYCLICS | SCHERING CORPORATION (US) | 1998-12-23 | — | — | WO | disclosed |