⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27517871 | 0.84 | — | — | |
| SCHEMBL277971 | 0.82 | — | — | |
| SCHEMBL28134932 | 0.78 | — | — | |
| SCHEMBL7966070 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL27733224 | 0.78 | — | — | |
| SCHEMBL27708038 | 0.78 | — | — | |
| SCHEMBL9702045 | 0.78 | — | — | |
| SCHEMBL27393212 | 0.78 | TSHR (0.32) | — | |
| SCHEMBL28232053 | 0.78 | — | — | |
| SCHEMBL27870523 | 0.72 | — | — |
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-1966173-A2 | HETEROCYCLIC DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF | Sanofi-Aventis (FR) | 2008-09-10 | — | — | EP | disclosed |
| WO-2007068815-A2 | HETEROCYCLIC DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2007-06-21 | — | — | WO | disclosed |