⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18855935 | 0.81 | ABL1 (0.37) | — | |
| SCHEMBL24242802 | 0.78 | — | — | |
| SCHEMBL24243062 | 0.77 | IKBKB (0.30) | — | |
| SCHEMBL18855625 | 0.75 | IRAK4 (0.32) | — | |
| SCHEMBL18855403 | 0.75 | — | — | |
| SCHEMBL18855604 | 0.73 | KDM4E (0.37) | — | |
| SCHEMBL18855737 | 0.73 | — | — | |
| SCHEMBL18855869 | 0.72 | NPC1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL1536094 | 0.72 | L3MBTL1 (0.50) | — | |
| SCHEMBL17827121 | 0.70 | PIK3CB (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3950692-A1 | NOVEL TRICYCLIC COMPOUNDS | AbbVie Inc. (US) | 2022-02-09 | — | — | EP | disclosed |
| EP-2506716-B1 | NOVEL TRICYCLIC COMPOUNDS | ABBVIE INC (US) | 2017-05-17 | — | — | EP | disclosed |