⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29262215 | 0.89 | — | — | |
| SCHEMBL28114280 | 0.67 | — | — | |
| SCHEMBL2929418 | 0.67 | — | — | |
| SCHEMBL9215323 | 0.63 | ALDH1A1 (0.31) | — | |
| SCHEMBL28213165 | 0.62 | — | — | |
| SCHEMBL27683830 | 0.62 | CCR2 (0.31) | — | |
| SCHEMBL30979209 | 0.62 | — | — | |
| SCHEMBL27386898 | 0.61 | TSHR (0.30) | — | |
| Benzene SCHEMBL27931563 | 0.61 | CCR2 (0.33) | — | |
| SCHEMBL11100378 | 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 |
|---|---|---|---|---|---|---|---|
| CN-118108888-A | Organic polymer carrier, Z-N catalyst, and preparation method and application thereof | 中国石油天然气股份有限公司 | 2024-05-31 | — | — | CN | disclosed |