⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL196119 | 1.00 | — | — | |
| SCHEMBL21645318 | 0.85 | — | — | |
| SCHEMBL8779728 | 0.78 | — | — | |
| SCHEMBL9352309 | 0.77 | — | — | |
| SCHEMBL9480903 | 0.74 | — | — | |
| SCHEMBL27802633 | 0.72 | — | — | |
| SCHEMBL2469866 | 0.72 | — | — | |
| SCHEMBL6200461 | 0.72 | — | — | |
| Methylphenylsulfoxide SCHEMBL3383118 | 0.71 | — | — | |
| Methylphenylsulfoxide SCHEMBL110574 | 0.71 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996025936-A1 | 2,6-DIARYL PYRIDAZINONES WITH IMMUNOSUPPRESSANT ACTIVITY | MERCK & CO., INC. (US) | 1996-08-29 | — | — | WO | disclosed |