⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14025921 | 1.00 | — | — | |
| SCHEMBL22458036 | 0.76 | — | — | |
| SCHEMBL22458038 | 0.76 | — | — | |
| SCHEMBL19135959 | 0.75 | NOS3 (0.32) | — | |
| SCHEMBL13881165 | 0.73 | GID4 (0.32) | — | |
| SCHEMBL12891558 | 0.73 | ADRA2A (0.45) | — | |
| SCHEMBL18708113 | 0.73 | GID4 (0.32) | — | |
| SCHEMBL12891559 | 0.73 | ADRA2A (0.45) | — | |
| SCHEMBL13117935 | 0.73 | GID4 (0.32) | — | |
| SCHEMBL13881339 | 0.73 | GID4 (0.32) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004052847-A2 | TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS | ELI LILLY AND COMPANY (US) | 2004-06-24 | — | — | WO | disclosed |