⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1280066 | 0.75 | MEN1 (0.33) | — | |
| SCHEMBL555524 | 0.75 | MEN1 (0.33) | — | |
| Perfluorocyclobutane SCHEMBL10391737 | 0.75 | MEN1 (0.33) | — | |
| SCHEMBL297814 | 0.75 | MEN1 (0.33) | — | |
| SCHEMBL149623 | 0.75 | MEN1 (0.33) | — | |
| SCHEMBL6885374 | 0.75 | MEN1 (0.33) | — | |
| SCHEMBL9604331 | 0.74 | — | — | |
| SCHEMBL3459613 | 0.72 | MEN1 (0.31) | — | |
| SCHEMBL3459463 | 0.71 | — | — | |
| SCHEMBL3459239 | 0.71 | — | — |
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-5183067-A | Uses highly fluorinated compound in a solvent | ISC CHEMICALS LIMITED (GB) | 1993-02-02 | — | — | US | disclosed |
| US-5055138-A | Covering flammable solvent surface with vapor layer rich in perfluorinated organic compound | ISC CHEMICALS LIMITED (GB) | 1991-10-08 | — | — | US | disclosed |