⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4586664 | 0.72 | — | — | |
| SCHEMBL7427769 | 0.56 | GPR3 (0.39) | — | |
| SCHEMBL7487949 | 0.56 | — | — | |
| SCHEMBL5341185 | 0.55 | KDM4E (0.38) | — | |
| SCHEMBL7436595 | 0.54 | — | — | |
| SCHEMBL9651515 | 0.53 | — | — | |
| SCHEMBL5325003 | 0.52 | — | — | |
| SCHEMBL19297731 | 0.52 | — | — | |
| SCHEMBL860304 | 0.52 | — | — | |
| SCHEMBL16825447 | 0.51 | — | — |
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-1954290-A2 | TRICYCLIC COMPOUNDS USEFUL AS INHIBITORS OF KINASES | Merck & Co., Inc. (US) | 2008-08-13 | — | — | EP | disclosed |
| WO-2007061764-A2 | TRICYCLIC COMPOUNDS USEFUL AS INHIBITORS OF KINASES | MERCK & CO., INC. (US) | 2007-05-31 | — | — | WO | disclosed |