⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20744405 | 1.00 | — | — | |
| SCHEMBL20743048 | 0.88 | USP30 (0.44) | — | |
| SCHEMBL30305351 | 0.87 | TLR8 (0.51) | — | |
| SCHEMBL30305354 | 0.87 | — | — | |
| SCHEMBL30305348 | 0.87 | — | — | |
| SCHEMBL20744468 | 0.87 | — | — | |
| SCHEMBL20744378 | 0.87 | — | — | |
| SCHEMBL20744317 | 0.87 | TLR8 (0.51) | — | |
| SCHEMBL15840441 | 0.84 | NAMPT (0.50) | — | |
| SCHEMBL20744291 | 0.82 | — | — |
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-111225910-B | Novel compounds | 葛兰素史密斯克莱知识产权发展有限公司 | 2023-03-24 | — | — | CN | claimed |
| CN-111225910-B | Novel compounds | 葛兰素史密斯克莱知识产权发展有限公司 | 2023-03-24 | — | — | CN | disclosed |