⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27890639 | 0.87 | — | — | |
| SCHEMBL4292879 | 0.87 | — | — | |
| SCHEMBL27861190 | 0.87 | — | — | |
| SCHEMBL27898007 | 0.87 | — | — | |
| SCHEMBL27891979 | 0.87 | — | — | |
| SCHEMBL23040974 | 0.87 | — | — | |
| SCHEMBL27907557 | 0.87 | — | — | |
| SCHEMBL2351156 | 0.82 | — | — | |
| SCHEMBL28850993 | 0.82 | — | — | |
| SCHEMBL32196 | 0.82 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106067392-A | A silver nanometre tin oxide electrical contact material | 西安烨森电子科技有限责任公司 | 2016-11-02 | — | — | CN | claimed |
| CN-112871184-A | Catalyst for preparing 1, 4-butanediol by fixed bed hydrogenation of 1, 4-butynediol and preparation method and application thereof | 大连理工大学 | 2021-06-01 | — | — | CN | disclosed |
| CN-106067392-A | A silver nanometre tin oxide electrical contact material | 西安烨森电子科技有限责任公司 | 2016-11-02 | — | — | CN | disclosed |
| CN-101143382-A | Niobium-containing micro-alloy steel slab continuous casting production technology | WUHAN IRON & STEEL GROUP CORP (CN) | 2008-03-19 | — | — | CN | disclosed |