⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8389036 | 0.85 | TSHR (0.41) | — | |
| SCHEMBL8385399 | 0.83 | MEN1 (0.32) | — | |
| SCHEMBL8384361 | 0.77 | TSHR (0.41) | — | |
| SCHEMBL10431263 | 0.73 | GSTP1 (0.33) | — | |
| SCHEMBL20335453 | 0.73 | TSHR (0.39) | — | |
| SCHEMBL11232234 | 0.70 | USP2 (0.44) | — | |
| SCHEMBL5422202 | 0.69 | TSHR (0.33) | — | |
| SCHEMBL5422213 | 0.69 | TSHR (0.33) | — | |
| SCHEMBL8389037 | 0.68 | TSHR (0.41) | — | |
| SCHEMBL23581952 | 0.68 | TSHR (0.35) | — |
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-5892037-A | Polymeric adducts of hindered amine-epoxides as stabilizers | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 1999-04-06 | — | — | US | disclosed |