⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10619641 | 0.73 | — | — | |
| SCHEMBL10619651 | 0.73 | — | — | |
| SCHEMBL13902817 | 0.73 | — | — | |
| SCHEMBL16589031 | 0.70 | — | — | |
| SCHEMBL10680124 | 0.68 | — | — | |
| SCHEMBL320739 | 0.68 | — | — | |
| SCHEMBL320740 | 0.68 | — | — | |
| SCHEMBL13530958 | 0.67 | — | — | |
| SCHEMBL751359 | 0.66 | — | — | |
| SCHEMBL18392864 | 0.66 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220106361-A1 | MACROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2022-04-07 | — | — | US | disclosed |