⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9044557 | 1.00 | — | — | |
| SCHEMBL22651958 | 0.98 | — | — | |
| SCHEMBL7490975 | 0.87 | — | — | |
| SCHEMBL7491125 | 0.84 | — | — | |
| SCHEMBL2670282 | 0.82 | — | — | |
| SCHEMBL7490307 | 0.82 | CTDSP1 (0.32) | — | |
| SCHEMBL8295498 | 0.78 | — | — | |
| SCHEMBL3138747 | 0.78 | MEN1 (0.34) | — | |
| SCHEMBL5421843 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL2919397 | 0.73 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100376324-C | Novel nickel-carbene, palladium-carbene and platinum-carbene complexes, their production and use in catalytic reactions | UMICORE AG & CO KG (DE) | 2008-03-26 | — | — | CN | claimed |
| US-7268233-B2 | Nickel-carbene, palladium-carbene and platinum-carbene complexes, their production and use in catalytic reactions | UMICORE AG & CO. KG (DE) | 2007-09-11 | — | — | US | claimed |
| CN-100376324-C | Novel nickel-carbene, palladium-carbene and platinum-carbene complexes, their production and use in catalytic reactions | UMICORE AG & CO KG (DE) | 2008-03-26 | — | — | CN | disclosed |
| CN-1093401-C | Active oxygen, free radical scavenger | NIPPON ZOKI PHARMACEUTICAL CO (JP) | 2002-10-30 | — | — | CN | disclosed |
| CN-1159324-A | Active oxygen, free radical scavenger | NIPPON ZOKI PHARMACEUTICAL CO (JP) | 1997-09-17 | — | — | CN | disclosed |