⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2512468 | 0.76 | — | — | |
| SCHEMBL28703048 | 0.72 | — | — | |
| SCHEMBL30721508 | 0.72 | — | — | |
| SCHEMBL28994957 | 0.70 | — | — | |
| SCHEMBL30310796 | 0.70 | — | — | |
| SCHEMBL2512470 | 0.69 | — | — | |
| SCHEMBL1886307 | 0.68 | — | — | |
| SCHEMBL30670278 | 0.65 | — | — | |
| SCHEMBL29236046 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL11412157 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112592344-A | Indolo [2,3-b ] indole derivative and synthetic method thereof | 湘潭大学 | 2021-04-02 | — | — | CN | claimed |
| CN-112592344-B | Indolo [2,3-b ] indole derivative and synthetic method thereof | 湘潭大学 | 2021-12-10 | — | — | CN | disclosed |
| CN-112592344-A | Indolo [2,3-b ] indole derivative and synthetic method thereof | 湘潭大学 | 2021-04-02 | — | — | CN | disclosed |