⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7931045 | 0.74 | — | — | |
| SCHEMBL7919428 | 0.69 | — | — | |
| SCHEMBL7928414 | 0.68 | — | — | |
| SCHEMBL525718 | 0.66 | — | — | |
| SCHEMBL449043 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL3693819 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL9233653 | 0.63 | — | — | |
| SCHEMBL3887277 | 0.63 | — | — | |
| SCHEMBL14718645 | 0.63 | — | — | |
| SCHEMBL21356236 | 0.63 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118085151-A | Technological method and system for preparing polyethylene elastomer by one-step method | 贝欧亿(山东)新材料有限公司 | 2024-05-28 | — | — | CN | disclosed |
| US-5625086-A | Process for the preparation of cyclopentadienyltrialkoxytitanium derivatives | WITCO GMBH (DE) | 1997-04-29 | — | — | US | disclosed |