⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7063526 | 0.67 | — | — | |
| SCHEMBL12879761 | 0.67 | — | — | |
| SCHEMBL11956543 | 0.62 | — | — | |
| SCHEMBL8292825 | 0.60 | — | — | |
| SCHEMBL11180942 | 0.59 | L3MBTL1 (0.38) | — | |
| SCHEMBL13008223 | 0.58 | — | — | |
| SCHEMBL27996565 | 0.56 | — | — | |
| SCHEMBL9404506 | 0.54 | — | — | |
| SCHEMBL269978 | 0.54 | — | — | |
| SCHEMBL7532735 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230118751-A1 | FUSED RING COMPOUND AND APPLICATION THEREOF | WUHAN LL SCIENCE AND TECHNOLOGY DEVELOPMENT CO., LTD. (CN) | 2023-04-20 | — | — | US | disclosed |
| US-9725436-B2 | Cytochrome P450 inhibitors and their method of use | CORTENDO AB (PUBL) (US) | 2017-08-08 | — | — | US | disclosed |