⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL179795 | 0.76 | — | — | |
| SCHEMBL31115945 | 0.74 | — | — | |
| SCHEMBL19321612 | 0.66 | — | — | |
| SCHEMBL5434263 | 0.61 | — | — | |
| SCHEMBL27453811 | 0.61 | — | — | |
| SCHEMBL9732676 | 0.60 | — | — | |
| SCHEMBL8940156 | 0.58 | — | — | |
| SCHEMBL29150912 | 0.58 | — | — | |
| SCHEMBL28745132 | 0.57 | — | — | |
| SCHEMBL8215344 | 0.57 | — | — |
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-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 |