⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3925360 | 0.77 | PDK1 (0.36) | — | |
| SCHEMBL2571959 | 0.75 | — | — | |
| SCHEMBL28172122 | 0.75 | EIF2AK4 (0.32) | — | |
| SCHEMBL28864615 | 0.74 | KIT (0.30) | — | |
| SCHEMBL29022143 | 0.73 | — | — | |
| SCHEMBL23878063 | 0.71 | — | — | |
| SCHEMBL23878065 | 0.71 | — | — | |
| SCHEMBL3758975 | 0.71 | — | — | |
| SCHEMBL14812645 | 0.70 | SMN1; SMN2 (0.40) | — | |
| SCHEMBL3011888 | 0.70 | POLB (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115244047-A | Indazole derivative and application thereof in medicine | 四川海思科制药有限公司 | 2022-10-25 | — | — | CN | disclosed |