⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27054298 | 0.78 | — | — | |
| SCHEMBL22201886 | 0.74 | — | — | |
| SCHEMBL23419387 | 0.72 | ALDH1A1 (0.31) | — | |
| SCHEMBL26268383 | 0.72 | ALDH1A1 (0.30) | — | |
| SCHEMBL18535546 | 0.66 | — | — | |
| SCHEMBL20323325 | 0.66 | — | — | |
| SCHEMBL19840527 | 0.65 | — | — | |
| SCHEMBL12379119 | 0.65 | ALDH1A1 (0.30) | — | |
| SCHEMBL12379131 | 0.64 | CHRM5 (0.33) | — | |
| SCHEMBL17265574 | 0.64 | — | — |
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-20210155926-A1 | siRNAs WITH AT LEAST TWO LIGANDS AT DIFFERENT ENDS | SILENCE THERAPEUTICS GMBH (DE) | 2021-05-27 | — | — | US | disclosed |