⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL515456 | 0.75 | — | — | |
| SCHEMBL31709992 | 0.72 | MEN1 (0.86) | — | |
| SCHEMBL9093617 | 0.72 | MEN1 (0.86) | — | |
| SCHEMBL14916717 | 0.72 | MEN1 (0.86) | — | |
| SCHEMBL136652 | 0.72 | — | — | |
| SCHEMBL23398193 | 0.67 | MEN1 (0.75) | — | |
| SCHEMBL887970 | 0.67 | MEN1 (0.75) | — | |
| SCHEMBL144783 | 0.67 | MEN1 (0.75) | — | |
| SCHEMBL3899631 | 0.67 | MEN1 (0.75) | — | |
| SCHEMBL3907819 | 0.67 | MEN1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115028175-A | Preparation method of lamellar ZSM-5 molecular sieve | 太原理工大学 | 2022-09-09 | — | — | CN | disclosed |