⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21758078 | 0.91 | — | — | |
| SCHEMBL21758079 | 0.76 | TP53 (0.31) | — | |
| SCHEMBL21758137 | 0.73 | — | — | |
| SCHEMBL21758082 | 0.70 | — | — | |
| SCHEMBL13233678 | 0.65 | — | — | |
| SCHEMBL21758081 | 0.63 | TP53 (0.34) | — | |
| SCHEMBL13879945 | 0.62 | — | — | |
| SCHEMBL12361696 | 0.62 | — | — | |
| SCHEMBL17431101 | 0.62 | — | — | |
| SCHEMBL19750883 | 0.61 | — | — |
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-20200062783-A1 | PHOTO LEWIS ACID GENERATOR | NIPPON SHOKUBAI CO., LTD. (JP) | 2020-02-27 | — | — | US | disclosed |