⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7857598 | 1.00 | — | — | |
| SCHEMBL3819587 | 0.73 | — | — | |
| SCHEMBL13040178 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL28177242 | 0.70 | — | — | |
| SCHEMBL12169901 | 0.66 | — | — | |
| SCHEMBL12091672 | 0.63 | — | — | |
| SCHEMBL8350010 | 0.62 | — | — | |
| SCHEMBL177717 | 0.62 | — | — | |
| SCHEMBL9372107 | 0.62 | — | — | |
| SCHEMBL9379775 | 0.62 | — | — |
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 |