⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11201 | 0.97 | — | — | |
| SCHEMBL7665917 | 0.94 | — | — | |
| SCHEMBL31070845 | 0.94 | — | — | |
| SCHEMBL1494467 | 0.88 | — | — | |
| SCHEMBL1494418 | 0.85 | TSHR (0.47) | — | |
| SCHEMBL17090830 | 0.85 | TSHR (0.47) | — | |
| SCHEMBL17090810 | 0.85 | TSHR (0.47) | — | |
| SCHEMBL1494194 | 0.85 | TSHR (0.47) | — | |
| SCHEMBL17090825 | 0.85 | TSHR (0.47) | — | |
| SCHEMBL17090767 | 0.85 | TSHR (0.47) | — |
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-110627072-A | Silica gel curing agent for preparing heat insulation material and preparation method thereof | 国佳新材湖北环保凝胶产业园有限公司 | 2019-12-31 | — | — | CN | claimed |
| CN-110627072-B | Silica gel curing agent for preparing heat insulation material and preparation method thereof | 武汉兴应硅材料有限公司 | 2021-03-19 | — | — | CN | disclosed |
| CN-110627072-A | Silica gel curing agent for preparing heat insulation material and preparation method thereof | 国佳新材湖北环保凝胶产业园有限公司 | 2019-12-31 | — | — | CN | disclosed |