⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27104772 | 0.89 | TLR4 (0.30) | — | |
| SCHEMBL2742874 | 0.89 | — | — | |
| SCHEMBL14366959 | 0.89 | — | — | |
| SCHEMBL1642430 | 0.88 | — | — | |
| SCHEMBL12674234 | 0.88 | — | — | |
| SCHEMBL10005840 | 0.88 | — | — | |
| SCHEMBL25485084 | 0.87 | — | — | |
| SCHEMBL21675978 | 0.87 | — | — | |
| SCHEMBL14925694 | 0.86 | — | — | |
| SCHEMBL17250026 | 0.86 | — | — |
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-20230158166-A1 | BIOLOGICALLY ACTIVE COMPOUNDS | SUTURA THERAPEUTICS LTD (GB) | 2023-05-25 | — | — | US | disclosed |