⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21737603 | 0.73 | — | — | |
| SCHEMBL5157339 | 0.66 | — | — | |
| SCHEMBL19590679 | 0.62 | — | — | |
| SCHEMBL13833514 | 0.62 | — | — | |
| SCHEMBL5151062 | 0.62 | — | — | |
| SCHEMBL20844128 | 0.59 | — | — | |
| SCHEMBL20708924 | 0.57 | XPO1 (0.36) | — | |
| SCHEMBL1836287 | 0.57 | — | — | |
| SCHEMBL8986074 | 0.56 | MAPT (0.56) | — | |
| SCHEMBL29540711 | 0.56 | MAPT (0.56) | — |
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-4242495-A | COATINGS, MOLDINGS, FOAMS | THE FIRESTONE TIRE & RUBBER COMPANY (US) | 1980-12-30 | — | — | US | disclosed |