⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25515301 | 0.90 | — | — | |
| SCHEMBL25455807 | 0.85 | — | — | |
| SCHEMBL25517876 | 0.81 | — | — | |
| SCHEMBL20306451 | 0.80 | NPSR1 (0.32) | — | |
| SCHEMBL14999029 | 0.79 | — | — | |
| SCHEMBL25517868 | 0.78 | — | — | |
| SCHEMBL10134899 | 0.77 | NPSR1 (0.36) | — | |
| SCHEMBL19042196 | 0.77 | NPSR1 (0.36) | — | |
| SCHEMBL18785739 | 0.76 | — | — | |
| SCHEMBL12376785 | 0.75 | ALDH1A1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230161243-A1 | SALT, ACID GENERATOR, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2023-05-25 | — | — | US | disclosed |