⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7591047 | 1.00 | — | — | |
| SCHEMBL30006426 | 0.84 | TDP1 (0.39) | — | |
| SCHEMBL28683670 | 0.78 | — | — | |
| SCHEMBL25310271 | 0.77 | — | — | |
| SCHEMBL14481003 | 0.77 | HSD17B10 (0.33) | — | |
| SCHEMBL14481182 | 0.77 | HSD17B10 (0.33) | — | |
| SCHEMBL1258831 | 0.77 | — | — | |
| SCHEMBL13260076 | 0.76 | TSHR (0.37) | — | |
| SCHEMBL27832475 | 0.75 | — | — | |
| SCHEMBL21449806 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025043152-A1 | METHODS OF DEALKENYLATIVE AMINATION AND AZIDATION | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2025-02-27 | — | — | WO | disclosed |