⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24829588 | 0.64 | BCHE (0.30) | — | |
| SCHEMBL14611175 | 0.64 | BCHE (0.30) | — | |
| SCHEMBL21914904 | 0.61 | — | — | |
| SCHEMBL17538768 | 0.55 | CHRM2 (0.43) | — | |
| SCHEMBL14400778 | 0.55 | — | — | |
| SCHEMBL13811435 | 0.53 | — | — | |
| SCHEMBL24900399 | 0.53 | — | — | |
| SCHEMBL13513006 | 0.53 | — | — | |
| SCHEMBL11947279 | 0.53 | — | — | |
| SCHEMBL823009 | 0.53 | — | — |
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-11332733-B2 | Modified compounds and uses thereof | lonis Pharmaceuticals, Inc. (US) | 2022-05-17 | — | — | US | disclosed |