⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13619245 | 0.90 | CA2 (0.31) | — | |
| SCHEMBL6799687 | 0.86 | — | — | |
| SCHEMBL2683711 | 0.86 | — | — | |
| SCHEMBL30116202 | 0.82 | OPRM1 (0.37) | — | |
| SCHEMBL15508041 | 0.81 | — | — | |
| SCHEMBL25899583 | 0.81 | — | — | |
| SCHEMBL16928574 | 0.81 | — | — | |
| SCHEMBL8063012 | 0.81 | FAAH (0.37) | — | |
| SCHEMBL8072842 | 0.80 | CA2 (0.40) | — | |
| SCHEMBL4820816 | 0.78 | CA2 (0.31) | — |
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-20230234978-A1 | NUCLEIC ACID-POLYPEPTIDE COMPOSITIONS AND USES THEREOF | Atrium Therapeutics, Inc. | 2023-07-27 | — | — | US | disclosed |