⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL441202 | 0.83 | — | — | |
| Morpholine SCHEMBL10437036 | 0.71 | MEN1 (0.48) | — | |
| SCHEMBL3670577 | 0.70 | KDM4E (0.39) | — | |
| SCHEMBL1830024 | 0.69 | — | — | |
| SCHEMBL17319684 | 0.67 | — | — | |
| SCHEMBL11123895 | 0.65 | — | — | |
| SCHEMBL19956080 | 0.65 | MEN1 (0.52) | — | |
| SCHEMBL29231134 | 0.64 | — | — | |
| SCHEMBL622521 | 0.63 | — | — | |
| SCHEMBL78482 | 0.61 | — | — |
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-113767092-B | Di-heterocyclic carbonyl substituted dihydropyrazoles, their preparation and their use in medicine | 劲方医药科技(上海)有限公司 | 2024-07-16 | — | — | CN | disclosed |
| CN-115551867-B | Fused tricyclic compounds, pharmaceutical compositions and uses thereof | 劲方医药科技(上海)有限公司 | 2024-02-20 | — | — | CN | disclosed |
| CN-117279896-A | Amino substituted pyrido ring compounds, preparation method and application thereof | 劲方医药科技(上海)有限公司 | 2023-12-22 | — | — | CN | disclosed |