⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31555357 | 0.87 | KDM5B (0.31) | — | |
| SCHEMBL17973799 | 0.79 | GCGR (0.32) | — | |
| SCHEMBL23370449 | 0.77 | — | — | |
| SCHEMBL25467513 | 0.75 | — | — | |
| SCHEMBL12316312 | 0.75 | MEN1 (0.31) | — | |
| SCHEMBL24832731 | 0.74 | — | — | |
| SCHEMBL10073170 | 0.73 | KDM5B (0.34) | — | |
| SCHEMBL12795977 | 0.72 | GCGR (0.33) | — | |
| SCHEMBL18999980 | 0.70 | — | — | |
| SCHEMBL12795957 | 0.70 | KDM5B (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230203060-A1 | FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF | GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) | 2023-06-29 | — | — | US | disclosed |
| WO-2021239058-A1 | FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF | 劲方医药科技(上海)有限公司 | 2021-12-02 | — | — | WO | disclosed |