⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8645643 | 0.57 | — | — | |
| SCHEMBL8645494 | 0.57 | — | — | |
| SCHEMBL10784434 | 0.54 | — | — | |
| SCHEMBL2264026 | 0.48 | — | — | |
| SCHEMBL8927303 | 0.48 | — | — | |
| SCHEMBL1036967 | 0.42 | — | — | |
| SCHEMBL21021468 | 0.42 | — | — | |
| SCHEMBL6554829 | 0.40 | — | — | |
| SCHEMBL2764664 | 0.40 | — | — | |
| SCHEMBL29495 | 0.40 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5773437-A | UROGENITAL DISORDERS SUCH AS DYSURIA | NIPPON CHEMIPHAR CO., LTD. (JP) | 1998-06-30 | — | — | US | disclosed |