⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9587309 | 0.89 | — | — | |
| SCHEMBL9588075 | 0.81 | — | — | |
| SCHEMBL9587347 | 0.81 | — | — | |
| SCHEMBL743649 | 0.79 | — | — | |
| SCHEMBL5070473 | 0.79 | — | — | |
| SCHEMBL11861914 | 0.79 | — | — | |
| SCHEMBL9587200 | 0.76 | — | — | |
| SCHEMBL9587769 | 0.74 | — | — | |
| SCHEMBL10811845 | 0.74 | LMNA (0.36) | — | |
| SCHEMBL8998782 | 0.74 | LMNA (0.36) | — |
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-5840998-A | Side chain chlorination of aromatic and heterocyclic ethers | OCCIDENTAL CHEMICAL CORPORATION (US) | 1998-11-24 | — | — | US | disclosed |