⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6969356 | 1.00 | — | — | |
| SCHEMBL17224961 | 0.79 | — | — | |
| SCHEMBL9464218 | 0.79 | — | — | |
| SCHEMBL9464668 | 0.79 | — | — | |
| SCHEMBL17224962 | 0.79 | — | — | |
| SCHEMBL9516454 | 0.79 | — | — | |
| SCHEMBL13415884 | 0.78 | CHRM2 (0.31) | — | |
| Potassium Ion SCHEMBL10352669 | 0.77 | CHRM2 (0.31) | — | |
| SCHEMBL8569989 | 0.77 | — | — | |
| SCHEMBL9429335 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |