⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL176837 | 0.96 | — | — | |
| SCHEMBL10345342 | 0.75 | — | — | |
| SCHEMBL8625630 | 0.72 | — | — | |
| SCHEMBL10774693 | 0.69 | — | — | |
| SCHEMBL3726087 | 0.69 | — | — | |
| SCHEMBL28263195 | 0.67 | TSHR (0.33) | — | |
| SCHEMBL11571715 | 0.67 | ALPG (0.32) | — | |
| SCHEMBL9808077 | 0.67 | — | — | |
| SCHEMBL11295714 | 0.65 | — | — | |
| SCHEMBL11208222 | 0.65 | — | — |
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-109081944-A | Dialkyl dithio hypophosphite fire retardant and its application | 浙江大学 | 2018-12-25 | — | — | CN | disclosed |