⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28046822 | 0.87 | — | — | |
| SCHEMBL27923053 | 0.87 | — | — | |
| SCHEMBL27895143 | 0.87 | — | — | |
| SCHEMBL28671984 | 0.87 | — | — | |
| SCHEMBL29046447 | 0.87 | — | — | |
| SCHEMBL6579144 | 0.87 | — | — | |
| SCHEMBL6579139 | 0.87 | — | — | |
| SCHEMBL27482278 | 0.87 | — | — | |
| Water SCHEMBL15768047 | 0.75 | — | — | |
| SCHEMBL11226650 | 0.75 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114029474-B | Nodular cast iron-gray cast iron composite brake drum and preparation method thereof | 山西汤荣机械制造股份有限公司 | 2022-12-16 | — | — | CN | claimed |
| CN-114029474-B | Nodular cast iron-gray cast iron composite brake drum and preparation method thereof | 山西汤荣机械制造股份有限公司 | 2022-12-16 | — | — | CN | disclosed |