⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2318104 | 0.82 | PTGDR2 (0.36) | — | |
| SCHEMBL13579549 | 0.72 | HTR6 (0.35) | — | |
| SCHEMBL13580578 | 0.71 | TP53 (0.36) | — | |
| SCHEMBL17226416 | 0.67 | — | — | |
| SCHEMBL2320310 | 0.66 | LATS1 (0.37) | — | |
| SCHEMBL2314750 | 0.66 | PTGS1 (0.37) | — | |
| SCHEMBL2319238 | 0.64 | CYP11B1 (0.39) | — | |
| SCHEMBL2319349 | 0.64 | MAPT (0.41) | — | |
| SCHEMBL16517899 | 0.62 | CCNK (0.38) | — | |
| SCHEMBL1536826 | 0.62 | L3MBTL1 (0.50) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160326181-A1 | NOVEL TRICYCLIC COMPOUNDS | ABBVIE INC. (US) | 2016-11-10 | — | — | US | disclosed |
| US-9365579-B2 | Tricyclic compounds | ABBVIE INC. (US) | 2016-06-14 | — | — | US | disclosed |
| US-20150210708-A1 | NOVEL TRICYCLIC COMPOUNDS | ABBVIE INC. (US) | 2015-07-30 | — | — | US | disclosed |
| US-8962629-B2 | Tricyclic compounds | ABBVIE INC. (US) | 2015-02-24 | — | — | US | disclosed |
| US-20090312338-A1 | Novel Tricyclic Compounds | ABBOTT LABORATORIES (US) | 2009-12-17 | — | — | US | disclosed |