⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2754689 | 0.76 | — | — | |
| Bromide SCHEMBL28426341 | 0.74 | — | — | |
| Iodide SCHEMBL26646446 | 0.74 | — | — | |
| Water SCHEMBL27734046 | 0.74 | — | — | |
| Ammonia Solution, Strong SCHEMBL7554432 | 0.74 | — | — | |
| Bromide SCHEMBL17183943 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL10719593 | 0.74 | — | — | |
| Iodide SCHEMBL28445795 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL28464284 | 0.74 | — | — | |
| SCHEMBL28020226 | 0.74 | — | — |
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-3732210-A1 | COMPOSITION INCLUDING MULTIPLE TERMINALLY FUNCTIONALIZED POLYMERS | Bridgestone Corporation (JP) | 2020-11-04 | — | — | EP | disclosed |