⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1800278 | 0.67 | — | — | |
| SCHEMBL11441704 | 0.67 | — | — | |
| SCHEMBL6910841 | 0.65 | — | — | |
| SCHEMBL27656512 | 0.65 | — | — | |
| Fluoride SCHEMBL14954374 | 0.65 | — | — | |
| Bromide SCHEMBL5395223 | 0.62 | — | — | |
| Fluoride SCHEMBL14954032 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL11041276 | 0.62 | — | — | |
| SCHEMBL1686479 | 0.62 | — | — | |
| Fluoride SCHEMBL5401001 | 0.62 | — | — |
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-6645302-B2 | Vapor phase deposition system | SHOWA DENKO KABUSHIKI KAISHA (JP) | 2003-11-11 | — | — | US | disclosed |
| US-20010035530-A1 | Vapor phase deposition system | SHOWA DENKO KABUSHIKI KAISHA (JP) | 2001-11-01 | — | — | US | disclosed |