⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16563019 | 0.81 | ANPEP (0.38) | — | |
| SCHEMBL9792160 | 0.80 | LMNA (0.39) | — | |
| SCHEMBL18947465 | 0.79 | — | — | |
| SCHEMBL18947466 | 0.77 | MAOA (0.32) | — | |
| SCHEMBL14997803 | 0.75 | EPHX1 (0.49) | — | |
| SCHEMBL24346553 | 0.74 | LMNA (0.48) | — | |
| SCHEMBL1507574 | 0.74 | LMNA (0.48) | — | |
| SCHEMBL1507386 | 0.74 | LMNA (0.48) | — | |
| SCHEMBL1507434 | 0.74 | LMNA (0.48) | — | |
| SCHEMBL518293 | 0.74 | LMNA (0.48) | — |
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-9676964-B1 | Visible light activated aqueous based self-decontaminating coating composition | LOMBARDI JOHN L (US) | 2017-06-13 | — | — | US | disclosed |