⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28961093 | 0.83 | — | — | |
| SCHEMBL471842 | 0.69 | — | — | |
| SCHEMBL8667227 | 0.67 | TSHR (0.32) | — | |
| SCHEMBL20290963 | 0.67 | — | — | |
| SCHEMBL13958294 | 0.65 | — | — | |
| SCHEMBL20076796 | 0.65 | ALDH1A1 (0.35) | — | |
| SCHEMBL8076493 | 0.65 | — | — | |
| SCHEMBL21159757 | 0.65 | — | — | |
| Bicarbonate SCHEMBL1080335 | 0.65 | LMNA (0.35) | — | |
| SCHEMBL8076492 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023109942-A1 | COMPOUND-LINKER CONSTRUCTS COMPRISING NOVEL COMPOUNDS USEFUL AS STING AGONISTS AND USES THEREOF | JACOBIO PHARMACEUTICALS CO., LTD. (CN) | 2023-06-22 | — | — | WO | disclosed |