⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL406957 | 0.82 | — | — | |
| SCHEMBL23926920 | 0.82 | — | — | |
| SCHEMBL28343117 | 0.82 | — | — | |
| SCHEMBL250476 | 0.82 | — | — | |
| SCHEMBL9487243 | 0.67 | — | — | |
| Water SCHEMBL23780025 | 0.67 | — | — | |
| SCHEMBL23199790 | 0.67 | — | — | |
| Fluoride SCHEMBL21493368 | 0.67 | — | — | |
| SCHEMBL22128061 | 0.67 | — | — | |
| SCHEMBL6699383 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5808411-A | CERIUM DOPE | PATENT-TREUHAND-GESELLSCHAFT F. ELEKTRISCHE GLUEHLAMPEN MBH (DE) | 1998-09-15 | — | — | US | disclosed |
| US-5589734-A | ULTRAVIOLET RADIATION OF QUARTZ GLASS | PATENT-TREUHAND-GESELLSCHAFT F. ELEKTRISCHE GLUEHLAMPEN MBH (DE) | 1996-12-31 | — | — | US | disclosed |