⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3136179 | 0.86 | — | — | |
| SCHEMBL1680194 | 0.82 | — | — | |
| SCHEMBL167936 | 0.80 | — | — | |
| SCHEMBL16808804 | 0.80 | — | — | |
| SCHEMBL810782 | 0.79 | — | — | |
| SCHEMBL244226 | 0.77 | — | — | |
| SCHEMBL22830370 | 0.75 | — | — | |
| SCHEMBL15825726 | 0.70 | — | — | |
| SCHEMBL169030 | 0.70 | — | — | |
| SCHEMBL231277 | 0.69 | — | — |
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-4499221-A | NITROGEN CONTAINING POLYMER STABILIZERS POLYURETHANE | TOYO BOSEKI KABUSHIKI KAISHA (JP) | 1985-02-12 | — | — | US | disclosed |