⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6515368 | 0.91 | — | — | |
| SCHEMBL6516734 | 0.91 | — | — | |
| SCHEMBL9246502 | 0.91 | — | — | |
| SCHEMBL9250280 | 0.86 | — | — | |
| SCHEMBL9775429 | 0.82 | — | — | |
| SCHEMBL1959035 | 0.80 | — | — | |
| SCHEMBL13231310 | 0.78 | — | — | |
| SCHEMBL664825 | 0.76 | — | — | |
| SCHEMBL2190584 | 0.76 | — | — | |
| SCHEMBL6734537 | 0.73 | — | — |
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-5386069-A | Process for preparation of difluoro-tetraiodobenzene | EASTMAN CHEMICAL COMPANY (US) | 1995-01-31 | — | — | US | disclosed |