⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22059379 | 0.95 | — | — | |
| SCHEMBL21985212 | 0.91 | — | — | |
| SCHEMBL20203358 | 0.84 | — | — | |
| SCHEMBL23187868 | 0.80 | CA1 (0.41) | — | |
| SCHEMBL21985067 | 0.78 | — | — | |
| SCHEMBL24406018 | 0.75 | CA1 (0.37) | — | |
| SCHEMBL22278538 | 0.71 | PADI4 (0.39) | — | |
| SCHEMBL14424217 | 0.67 | — | — | |
| SCHEMBL24726919 | 0.65 | — | — | |
| SCHEMBL24727147 | 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-20220112152-A1 | TRIPHENYLPHOSPHONIUM-TETHERED SALICYLAMINE DERIVATIVES | MTI BIOTECH, INC. | 2022-04-14 | — | — | US | disclosed |