⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1711999 | 0.74 | — | — | |
| SCHEMBL15209806 | 0.74 | — | — | |
| SCHEMBL2089554 | 0.69 | — | — | |
| SCHEMBL15618412 | 0.68 | L3MBTL1 (0.37) | — | |
| SCHEMBL2232933 | 0.67 | PDE4A (0.33) | — | |
| SCHEMBL15717508 | 0.67 | — | — | |
| SCHEMBL2421745 | 0.64 | — | — | |
| SCHEMBL6964827 | 0.64 | — | — | |
| SCHEMBL28447016 | 0.62 | TLR4 (0.33) | — | |
| SCHEMBL7620778 | 0.61 | KDM1A (0.39) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110418790-B | Imidazopyrrolone compounds as p53-MDM2 inhibitors | 罗欣药业(上海)有限公司 | 2022-05-17 | — | — | CN | disclosed |
| EP-2001863-A1 | 2-(CYCLIC AMINO)-PYRIMIDONE DERIVATIVES AS TPK1 INHIBITORS | Mitsubishi Tanabe Pharma Corporation (JP) | 2008-12-17 | — | — | EP | disclosed |
| WO-2007119463-A1 | 2-(CYCLIC AMINO)-PYRIMIDONE DERIVATIVES AS TPK1 INHIBITORS | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2007-10-25 | — | — | WO | disclosed |
| WO-1996014844-A1 | CYCLIC AMIDINE ANALOGS AS INHIBITORS OF NITRIC OXIDE SYNTHASE | MERCK & CO., INC. (US) | 1996-05-23 | — | — | WO | disclosed |