⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14703233 | 0.74 | — | — | |
| SCHEMBL17274408 | 0.70 | — | — | |
| SCHEMBL3062382 | 0.62 | — | — | |
| SCHEMBL1199564 | 0.61 | — | — | |
| SCHEMBL12973030 | 0.60 | — | — | |
| SCHEMBL7584628 | 0.59 | — | — | |
| SCHEMBL19031995 | 0.58 | — | — | |
| SCHEMBL9902167 | 0.58 | — | — | |
| SCHEMBL4883832 | 0.57 | — | — | |
| SCHEMBL3070303 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5994540-A | HYDROXY- AND CHLORO-PYRIDYLPYRIDAZINONE DERIVATIVES | LONZA, LTD. (CH) | 1999-11-30 | — | — | US | disclosed |
| EP-0713869-B1 | Di- and trisubstituted pyridine derivatives and a process for their preparation | LONZA AG (CH) | 1999-04-28 | — | — | EP | disclosed |
| US-5760236-A | CHEMICAL INTERMEDIATES FOR PHARMACEUTICALS | LONZA, LTD. (CH) | 1998-06-02 | — | — | US | disclosed |
| EP-0713869-A2 | Di- and trisubstituted pyridine derivatives and a process for their preparation | LONZA AG (CH) | 1996-05-29 | — | — | EP | disclosed |