⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4096326 | 0.78 | POLB (0.36) | — | |
| SCHEMBL4085301 | 0.78 | TRPV4 (0.38) | — | |
| SCHEMBL4086856 | 0.72 | GBA1 (0.44) | — | |
| SCHEMBL3973752 | 0.71 | ALDH1A1 (0.46) | — | |
| SCHEMBL11816669 | 0.71 | ALDH1A1 (0.52) | — | |
| SCHEMBL3971781 | 0.69 | ALDH1A1 (0.46) | — | |
| SCHEMBL3972855 | 0.69 | SMN1; SMN2 (0.47) | — | |
| SCHEMBL3973730 | 0.69 | ADRA2A (0.46) | — | |
| SCHEMBL4087920 | 0.68 | MEN1 (0.39) | — | |
| SCHEMBL3969996 | 0.68 | MLYCD (0.43) | — |
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-2009053449-A1 | THIAZOLES WHICH POTENTIATE AMPA RECEPTOR AND MEDICINAL USES THEREOF | GLAXO GROUP LIMITED (GB) | 2009-04-30 | — | — | WO | disclosed |