⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24246702 | 0.73 | — | — | |
| SCHEMBL17031694 | 0.65 | — | — | |
| SCHEMBL25097205 | 0.65 | — | — | |
| SCHEMBL22370011 | 0.59 | — | — | |
| SCHEMBL20466538 | 0.59 | — | — | |
| SCHEMBL29299334 | 0.58 | — | — | |
| SCHEMBL13722872 | 0.58 | — | — | |
| SCHEMBL12169789 | 0.58 | — | — | |
| SCHEMBL22370007 | 0.58 | — | — | |
| SCHEMBL9891881 | 0.57 | GAA (0.33) | — |
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-10961252-B2 | Quinazoline and indole compounds to treat medical disorders | ACHILLION PHARMACEUTICALS, INC. (US) | 2021-03-30 | — | — | US | disclosed |