⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8337136 | 0.78 | TTR (0.31) | — | |
| SCHEMBL3831246 | 0.73 | TTR (0.37) | — | |
| SCHEMBL25477911 | 0.69 | CA12 (0.45) | — | |
| SCHEMBL27703672 | 0.66 | — | — | |
| SCHEMBL9141562 | 0.65 | TTR (0.39) | — | |
| SCHEMBL23559562 | 0.64 | TTR (0.31) | — | |
| SCHEMBL10498088 | 0.63 | TTR (0.50) | — | |
| SCHEMBL9356500 | 0.63 | TTR (0.43) | — | |
| SCHEMBL8203344 | 0.62 | NR1H2 (0.53) | — | |
| SCHEMBL23601630 | 0.62 | ESR1 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1628641-A2 | SOLID PARTICLES COMPRISING AN ANTICONVULSANT OR AN IMMUNOSUPPRESSIVE COATED WITH ONE OR MORE SURFACE MODIFIERS | BAXTER INTERNATIONAL INC. (US) | 2006-03-01 | — | — | EP | disclosed |
| WO-2004103348-A2 | SOLID PARTICLES COMPRISING AN ANTICONVULSANT OR AN IMMUNOSUPPRESSIVE COATED WITH ONE OR MORE SURFACE MODIFIERS | BAXTER INTERNATIONAL INC. (US) | 2004-12-02 | — | — | WO | disclosed |