⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28090955 | 0.98 | — | — | |
| SCHEMBL28102791 | 0.98 | — | — | |
| SCHEMBL27780456 | 0.97 | CYP19A1 (0.30) | — | |
| SCHEMBL27858961 | 0.95 | — | — | |
| SCHEMBL28091056 | 0.95 | — | — | |
| SCHEMBL11708156 | 0.67 | — | — | |
| SCHEMBL28021749 | 0.67 | — | — | |
| SCHEMBL968906 | 0.67 | CYP2C19 (0.31) | — | |
| SCHEMBL1581150 | 0.66 | CYP19A1 (0.31) | — | |
| SCHEMBL11591113 | 0.66 | CYP19A1 (0.31) | — |
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-114957977-A | Microporous-micronucleus functionalized flame-retardant polyamide resin | 北京理工大学 | 2022-08-30 | — | — | CN | disclosed |
| CN-103980662-B | A kind of ethoxyline resin antiflaming compositions and preparation method thereof | 江汉大学 | 2016-08-31 | — | — | CN | disclosed |