⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23966653 | 0.86 | HPGD (0.33) | — | |
| SCHEMBL12683817 | 0.81 | — | — | |
| SCHEMBL18626392 | 0.76 | LMNA (0.44) | — | |
| SCHEMBL19738612 | 0.76 | ALKBH5 (0.42) | — | |
| SCHEMBL19789897 | 0.72 | GPR3 (0.34) | — | |
| SCHEMBL18643605 | 0.72 | ALDH1A1 (0.31) | — | |
| SCHEMBL18643622 | 0.72 | ALDH1A1 (0.31) | — | |
| SCHEMBL18643636 | 0.72 | ALDH1A1 (0.31) | — | |
| SCHEMBL18627738 | 0.70 | ALDH1A1 (0.30) | — | |
| SCHEMBL18643620 | 0.70 | ALDH1A1 (0.30) | — |
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-11649249-B2 | Compounds for electronic devices | MERCK PATENT GMBH (DE) | 2023-05-16 | — | — | US | disclosed |