⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2332096 | 1.00 | — | — | |
| SCHEMBL13494713 | 1.00 | — | — | |
| SCHEMBL13351117 | 0.83 | FOLH1 (0.38) | — | |
| SCHEMBL14819043 | 0.82 | CHRM1 (0.44) | — | |
| SCHEMBL17706682 | 0.82 | CHRM1 (0.44) | — | |
| SCHEMBL16623914 | 0.81 | — | — | |
| SCHEMBL12437233 | 0.81 | — | — | |
| SCHEMBL20239054 | 0.81 | — | — | |
| SCHEMBL1569122 | 0.79 | — | — | |
| SCHEMBL10443312 | 0.79 | — | — |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |