⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20355940 | 0.80 | — | — | |
| SCHEMBL27347448 | 0.78 | — | — | |
| SCHEMBL25529578 | 0.72 | — | — | |
| SCHEMBL25062325 | 0.72 | — | — | |
| SCHEMBL16803975 | 0.72 | CHRNB2 (0.33) | — | |
| SCHEMBL30622388 | 0.72 | CHRNB2 (0.33) | — | |
| SCHEMBL12677909 | 0.72 | CHRNB2 (0.33) | — | |
| SCHEMBL19176571 | 0.72 | — | — | |
| SCHEMBL23911916 | 0.71 | — | — | |
| SCHEMBL19882659 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020066510-A1 | METHOD FOR PRODUCING POLYMER COMPOUND AND LIGHT-EMITTING ELEMENT | 住友化学株式会社 | 2020-04-02 | — | — | WO | disclosed |