⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4866958 | 0.76 | — | — | |
| SCHEMBL28234598 | 0.67 | — | — | |
| SCHEMBL28183997 | 0.66 | ALDH1A1 (0.43) | — | |
| SCHEMBL16694847 | 0.64 | — | — | |
| SCHEMBL15149 | 0.64 | — | — | |
| SCHEMBL11334103 | 0.64 | — | — | |
| SCHEMBL309967 | 0.63 | FDPS (0.39) | — | |
| SCHEMBL1165059 | 0.63 | FDPS (0.39) | — | |
| SCHEMBL2906953 | 0.62 | — | — | |
| SCHEMBL8148844 | 0.62 | RECQL (0.46) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0946508-B1 | NITROGEN CONTAINING HETEROAROMATICS AS FACTOR Xa INHIBITORS | BRISTOL MYERS SQUIBB PHARMA CO (US) | 2009-09-23 | — | — | EP | disclosed |
| EP-0526004-B1 | Pyrazolopyrimidinone antianginal agents | PFIZER LTD (GB) | 1997-10-08 | — | — | EP | disclosed |
| EP-0526004-A1 | Pyrazolopyrimidinone antianginal agents | Pfizer Limited (GB) | 1993-02-03 | — | — | EP | disclosed |