⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2690155 | 0.80 | TSHR (0.32) | — | |
| SCHEMBL946299 | 0.74 | BTN3A1 (0.30) | — | |
| SCHEMBL7560995 | 0.74 | — | — | |
| SCHEMBL5157841 | 0.70 | TSHR (0.36) | — | |
| SCHEMBL2639608 | 0.70 | TSHR (0.33) | — | |
| SCHEMBL3673258 | 0.70 | TSHR (0.33) | — | |
| SCHEMBL16932030 | 0.69 | THRB (0.33) | — | |
| SCHEMBL4183817 | 0.67 | TSHR (0.34) | — | |
| SCHEMBL338774 | 0.67 | MEN1 (0.36) | — | |
| SCHEMBL7950629 | 0.66 | MEN1 (0.31) | — |
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-0838475-B1 | Plasma display front panel | SUMITOMO CHEMICAL CO (JP) | 2002-07-31 | — | — | EP | disclosed |
| EP-0838475-A2 | Plasma display front panel | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1998-04-29 | — | — | EP | disclosed |