⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3657420 | 0.77 | NOTUM (0.30) | — | |
| SCHEMBL21339376 | 0.70 | BRD4 (0.32) | — | |
| SCHEMBL23663811 | 0.65 | — | — | |
| SCHEMBL12624272 | 0.65 | NEK2 (0.32) | — | |
| SCHEMBL19344899 | 0.64 | P2RX7 (0.34) | — | |
| SCHEMBL16190004 | 0.64 | P2RX7 (0.37) | — | |
| SCHEMBL22001634 | 0.62 | ALDH1A1 (0.33) | — | |
| SCHEMBL18806130 | 0.62 | GRIN2D (0.34) | — | |
| SCHEMBL11930018 | 0.62 | ALDH1A1 (0.31) | — | |
| SCHEMBL7357702 | 0.60 | ALDH1A1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230203060-A1 | FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF | GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) | 2023-06-29 | — | — | US | disclosed |
| US-20230203060-A1 | FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF | GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) | 2023-06-29 | — | — | US | disclosed |
| EP-3383179-B1 | MICROBIOCIDAL OXADIAZOLE DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2020-05-27 | — | — | EP | disclosed |