⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27857263 | 0.91 | — | — | |
| SCHEMBL9690427 | 0.89 | — | — | |
| SCHEMBL27707123 | 0.89 | — | — | |
| SCHEMBL28571112 | 0.80 | — | — | |
| SCHEMBL29012821 | 0.80 | — | — | |
| SCHEMBL28758730 | 0.80 | — | — | |
| SCHEMBL29507294 | 0.80 | — | — | |
| SCHEMBL29220065 | 0.80 | — | — | |
| SCHEMBL28438587 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL16859737 | 0.80 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117487462-A | Surface-modified cerium-based rare earth polishing powder with high trivalent cerium content and preparation method thereof | 上海理工大学 | 2024-02-02 | — | — | CN | disclosed |
| WO-2011102868-A1 | NEUTRALIZATION OF ACID AND PRODUCTION OF CARBONATE-CONTAINING COMPOSITIONS | CALERA CORPORATION (US) | 2011-08-25 | — | — | WO | disclosed |
| US-20110091366-A1 | NEUTRALIZATION OF ACID AND PRODUCTION OF CARBONATE-CONTAINING COMPOSITIONS | CALERA CORPORATION | 2011-04-21 | — | — | US | disclosed |