⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6177643 | 0.78 | — | — | |
| SCHEMBL3321261 | 0.76 | — | — | |
| SCHEMBL106681 | 0.74 | — | — | |
| SCHEMBL17099155 | 0.74 | — | — | |
| SCHEMBL9537491 | 0.72 | — | — | |
| SCHEMBL3750627 | 0.71 | — | — | |
| SCHEMBL3754429 | 0.69 | — | — | |
| SCHEMBL2769582 | 0.69 | — | — | |
| SCHEMBL3748319 | 0.68 | — | — | |
| SCHEMBL7518719 | 0.67 | TSHR (0.35) | — |
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-20100298138-A1 | Aminoazoline and Urea Derivatives for Combating Animal Pests | BASF SE (DE) | 2010-11-25 | — | — | US | disclosed |