⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL459259 | 0.97 | — | — | |
| Water SCHEMBL27489245 | 0.94 | — | — | |
| Phosphine SCHEMBL27930492 | 0.94 | — | — | |
| Methylamine SCHEMBL6699174 | 0.91 | — | — | |
| SCHEMBL27722388 | 0.86 | — | — | |
| SCHEMBL6303852 | 0.86 | TSHR (0.42) | — | |
| SCHEMBL1608863 | 0.86 | — | — | |
| SCHEMBL707438 | 0.83 | — | — | |
| SCHEMBL1609077 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL15206186 | 0.82 | TSHR (0.32) | — |
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-114846083-A | Sealant composition | 美国陶氏有机硅公司 | 2022-08-02 | — | — | CN | disclosed |
| CN-109153884-B | Composition for forming metal-containing film, method for producing composition for forming metal-containing film, semiconductor device, and method for producing semiconductor device | 三井化学株式会社 | 2021-03-09 | — | — | CN | disclosed |