⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10467193 | 1.00 | — | — | |
| SCHEMBL5815638 | 1.00 | — | — | |
| SCHEMBL5810097 | 1.00 | — | — | |
| SCHEMBL8604543 | 0.97 | TSHR (0.30) | — | |
| SCHEMBL5985729 | 0.90 | — | — | |
| SCHEMBL5984965 | 0.90 | — | — | |
| SCHEMBL5984571 | 0.90 | — | — | |
| SCHEMBL7622085 | 0.89 | TSHR (0.32) | — | |
| SCHEMBL28528236 | 0.88 | TSHR (0.30) | — | |
| SCHEMBL7178049 | 0.83 | TSHR (0.36) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0492223-B1 | Silanised pigments and their use in inhibiting yellowing of pigmented plastics | MERCK PATENT GMBH (DE) | 1996-07-24 | — | — | EP | disclosed |
| EP-0492223-A2 | Silanised pigments and their use in inhibiting yellowing of pigmented plastics | MERCK PATENT GmbH (DE) | 1992-07-01 | — | — | EP | disclosed |