⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1516033 | 0.71 | ALDH1A1 (0.34) | — | |
| SCHEMBL17309055 | 0.65 | CA2 (0.33) | — | |
| SCHEMBL2883405 | 0.64 | — | — | |
| SCHEMBL18782806 | 0.64 | — | — | |
| SCHEMBL31218164 | 0.64 | SLC6A2 (0.30) | — | |
| SCHEMBL28541914 | 0.64 | CA2 (0.32) | — | |
| SCHEMBL25320964 | 0.61 | CTSS (0.34) | — | |
| SCHEMBL28645329 | 0.61 | LMNA (0.31) | — | |
| SCHEMBL9101648 | 0.61 | CTSS (0.34) | — | |
| SCHEMBL2882738 | 0.60 | — | — |
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-2019020682-A1 | PROCESS FOR THE PREPARATION OF METALLIC NANO-PARTICLE LAYERS AND THEIR USE FOR DECORA-TIVE OR SECURITY ELEMENTS | BASF SE (DE) | 2019-01-31 | — | — | WO | disclosed |