⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5262831 | 0.74 | LMNA (0.31) | — | |
| SCHEMBL5913801 | 0.70 | — | — | |
| SCHEMBL803480 | 0.69 | HRH4 (0.40) | — | |
| SCHEMBL5914113 | 0.68 | MEN1 (0.39) | — | |
| SCHEMBL5914182 | 0.65 | CKS1B (0.31) | — | |
| SCHEMBL5914297 | 0.64 | GABRA1 (0.38) | — | |
| SCHEMBL13633692 | 0.63 | UHRF1 (0.33) | — | |
| SCHEMBL14200175 | 0.62 | TAAR1 (0.36) | — | |
| SCHEMBL24240133 | 0.61 | RPS6KA5 (0.30) | — | |
| SCHEMBL13074630 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20060069110-A1 | Substituted heterocyclic compounds and methods of use | AMGEN INC. | 2006-03-30 | — | — | US | disclosed |