⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5187656 | 0.70 | — | — | |
| SCHEMBL23071454 | 0.69 | MEN1 (0.31) | — | |
| SCHEMBL11077931 | 0.66 | MEN1 (0.31) | — | |
| SCHEMBL11077940 | 0.66 | MEN1 (0.31) | — | |
| SCHEMBL9752476 | 0.65 | ABCC4 (0.30) | — | |
| SCHEMBL10448620 | 0.65 | MEN1 (0.38) | — | |
| SCHEMBL9804568 | 0.65 | — | — | |
| SCHEMBL9619503 | 0.63 | — | — | |
| SCHEMBL10718408 | 0.63 | MEN1 (0.31) | — | |
| SCHEMBL5674805 | 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 |
|---|---|---|---|---|---|---|---|
| EP-0593877-B1 | Composition for optical material | SHOWA DENKO KK (JP) | 1999-01-27 | — | — | EP | claimed |