⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10496938 | 0.83 | — | — | |
| SCHEMBL5810097 | 0.83 | — | — | |
| SCHEMBL5815638 | 0.83 | — | — | |
| SCHEMBL10467193 | 0.83 | — | — | |
| SCHEMBL8994334 | 0.83 | — | — | |
| SCHEMBL8604543 | 0.80 | TSHR (0.30) | — | |
| SCHEMBL5985729 | 0.79 | — | — | |
| SCHEMBL5984965 | 0.79 | — | — | |
| SCHEMBL5984571 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL3116295 | 0.78 | TSHR (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6893626-B2 | Compositions for TRP-M8 binding and radioreceptor methods therewith | WEI EDWARD T (US) | 2005-05-17 | — | — | US | disclosed |
| US-20040161751-A1 | COMPOSITONS FOR TRP-M8 BINDING AND RADIORECEPTOR METHODS THEREWITH | WEI EDWARD T (US) | 2004-08-19 | — | — | US | disclosed |