⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29008790 | 0.80 | — | — | |
| SCHEMBL29008797 | 0.80 | — | — | |
| SCHEMBL12039277 | 0.80 | — | — | |
| Hydrochlorthiazide SCHEMBL15656550 | 0.65 | — | — | |
| Dioxane SCHEMBL28526581 | 0.65 | TTR (0.32) | — | |
| Hydrochlorthiazide SCHEMBL28204282 | 0.64 | — | — | |
| Hydrochlorthiazide SCHEMBL11654153 | 0.64 | — | — | |
| SCHEMBL11042263 | 0.64 | — | — | |
| SCHEMBL24073337 | 0.63 | — | — | |
| SCHEMBL11457501 | 0.63 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113105411-B | Hydrazone amide derivatives and pharmaceutical compositions | 深圳市三启药物开发有限公司 | 2023-03-17 | — | — | CN | claimed |
| CN-113105411-B | Hydrazone amide derivatives and pharmaceutical compositions | 深圳市三启药物开发有限公司 | 2023-03-17 | — | — | CN | disclosed |
| CN-113105411-A | Hydrazone amide derivatives and pharmaceutical compositions | 深圳市三启药物开发有限公司 | 2021-07-13 | — | — | CN | disclosed |
| CN-110330465-B | Hydrazone amide derivative and application thereof in preparation of alopecia prevention and treatment medicines | 深圳市三启药物开发有限公司 | 2021-05-11 | — | — | CN | disclosed |