⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28666645 | 0.86 | — | — | |
| SCHEMBL9500489 | 0.84 | — | — | |
| SCHEMBL27905052 | 0.74 | — | — | |
| SCHEMBL9338929 | 0.70 | — | — | |
| SCHEMBL6283190 | 0.70 | — | — | |
| SCHEMBL7764687 | 0.69 | THRB (0.35) | — | |
| SCHEMBL3414986 | 0.68 | — | — | |
| SCHEMBL8440307 | 0.68 | — | — | |
| SCHEMBL28343172 | 0.68 | — | — | |
| SCHEMBL28574342 | 0.67 | — | — |
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-111253515-B | Aqueous dispersion | 第一工业制药株式会社 | 2022-11-25 | — | — | CN | disclosed |
| CN-111253522-B | Aqueous dispersion | 第一工业制药株式会社 | 2022-10-14 | — | — | CN | disclosed |
| CN-111253515-A | Aqueous dispersion | 第一工业制药株式会社 | 2020-06-09 | — | — | CN | disclosed |