⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25603621 | 0.81 | — | — | |
| SCHEMBL29540199 | 0.77 | SPHK1 (0.35) | — | |
| SCHEMBL25893327 | 0.68 | RIPK1 (0.37) | — | |
| SCHEMBL22384807 | 0.67 | VDR (0.34) | — | |
| SCHEMBL4547564 | 0.66 | DPP4 (0.37) | — | |
| SCHEMBL679000 | 0.63 | — | — | |
| SCHEMBL16773934 | 0.63 | TGFBR1 (0.37) | — | |
| SCHEMBL24543149 | 0.62 | SPHK1 (0.36) | — | |
| SCHEMBL9229118 | 0.61 | — | — | |
| SCHEMBL16656709 | 0.61 | — | — |
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 |