⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9840435 | 0.72 | TSHR (0.38) | — | |
| SCHEMBL7723281 | 0.66 | TSHR (0.38) | — | |
| SCHEMBL704639 | 0.64 | — | — | |
| SCHEMBL2143395 | 0.64 | TSHR (0.41) | — | |
| SCHEMBL2984055 | 0.64 | — | — | |
| SCHEMBL853632 | 0.62 | — | — | |
| SCHEMBL703265 | 0.62 | — | — | |
| SCHEMBL5012163 | 0.62 | TSHR (0.47) | — | |
| SCHEMBL828335 | 0.62 | — | — | |
| SCHEMBL18600561 | 0.60 | TSHR (0.44) | — |
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-1799208-A2 | HETEROCYCLIC AROMATIC COMPOUNDS USEFUL AS GROWTH HORMONE SECRETAGOGUES | Brystol-Myers Squibb Company (US) | 2007-06-27 | — | — | EP | disclosed |
| WO-2006044359-A2 | HETEROCYCLIC AROMATIC COMPOUNDS USEFUL AS GROWTH HORMONE SECRETAGOGUES | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-04-27 | — | — | WO | disclosed |