Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28968520 | 0.97 | CYP2C19 (0.32) | — | |
| SCHEMBL30418339 | 0.94 | — | — | |
| SCHEMBL28968450 | 0.94 | — | — | |
| SCHEMBL28968497 | 0.94 | CA4 (0.33) | — | |
| Silver SCHEMBL21295010 | 0.94 | — | — | |
| SCHEMBL21295013 | 0.94 | — | — | |
| Potassium Ion SCHEMBL28968471 | 0.94 | CA4 (0.33) | — | |
| Zinc Ion SCHEMBL28968491 | 0.94 | — | — | |
| SCHEMBL28968487 | 0.94 | — | — | |
| SCHEMBL28968474 | 0.94 | — | — |
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-115785523-B | Composition and application of alpha/beta composite nucleating agent for regulating and controlling mechanical properties of polypropylene | 华东理工大学 | 2023-10-10 | — | — | CN | claimed |
| CN-115785523-A | Composition and application of alpha/beta composite nucleating agent for regulating and controlling mechanical property of polypropylene | 华东理工大学 | 2023-03-14 | — | — | CN | claimed |
| CN-115785523-A | Composition and application of alpha/beta composite nucleating agent for regulating and controlling mechanical property of polypropylene | 华东理工大学 | 2023-03-14 | — | — | CN | disclosed |