⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5914113 | 0.80 | MEN1 (0.39) | — | |
| SCHEMBL3924623 | 0.79 | CYP3A4 (0.32) | — | |
| SCHEMBL24240133 | 0.76 | RPS6KA5 (0.30) | — | |
| SCHEMBL5913947 | 0.74 | LMNA (0.38) | — | |
| SCHEMBL5914308 | 0.71 | AURKA (0.39) | — | |
| SCHEMBL5914182 | 0.71 | CKS1B (0.31) | — | |
| SCHEMBL5913827 | 0.70 | — | — | |
| SCHEMBL5914297 | 0.70 | GABRA1 (0.38) | — | |
| SCHEMBL5914422 | 0.68 | CYP1A2 (0.37) | — | |
| SCHEMBL21801997 | 0.66 | NCF1 (0.43) | — |
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 |