⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24543 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL30082001 | 0.73 | — | — | |
| SCHEMBL4290490 | 0.73 | — | — | |
| SCHEMBL7915914 | 0.73 | — | — | |
| SCHEMBL37654 | 0.73 | THRB (0.33) | — | |
| SCHEMBL28441168 | 0.73 | — | — | |
| SCHEMBL12660241 | 0.72 | — | — | |
| SCHEMBL1141891 | 0.70 | — | — | |
| SCHEMBL24445848 | 0.70 | — | — | |
| SCHEMBL8072630 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1444289-B1 | COATING COMPOSITION COMPRISING FLUOROCHEMICAL POLYETHER SILANE POLYCONDENSATE AND USE THEREOF | 3M INNOVATIVE PROPERTIES CO (US) | 2007-10-17 | — | — | EP | disclosed |