⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL977204 | 0.71 | — | — | |
| SCHEMBL234303 | 0.71 | — | — | |
| SCHEMBL11861932 | 0.69 | — | — | |
| SCHEMBL757929 | 0.64 | — | — | |
| SCHEMBL757930 | 0.64 | — | — | |
| SCHEMBL9445651 | 0.62 | — | — | |
| SCHEMBL23928 | 0.59 | — | — | |
| SCHEMBL975747 | 0.58 | — | — | |
| SCHEMBL2474868 | 0.58 | — | — | |
| SCHEMBL2123900 | 0.58 | — | — |
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-4433071-A | POLYESTERURETHANE WITH HALOGENATED FIRE RETARDANT AND UREA-FORMALDEHYDE RESIN | STAUFFER CHEMICAL COMPANY (US) | 1984-02-21 | — | — | US | claimed |