⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29951756 | 0.87 | — | — | |
| SCHEMBL29953791 | 0.83 | — | — | |
| SCHEMBL15334098 | 0.79 | — | — | |
| SCHEMBL29951859 | 0.76 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL29956452 | 0.75 | — | — | |
| SCHEMBL29955240 | 0.75 | — | — | |
| SCHEMBL963602 | 0.74 | L3MBTL1 (0.36) | — | |
| SCHEMBL15331786 | 0.73 | NPC1 (0.38) | — | |
| SCHEMBL15330802 | 0.73 | — | — | |
| SCHEMBL29951617 | 0.73 | — | — |
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 |