⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5331153 | 1.00 | — | — | |
| SCHEMBL27462061 | 0.97 | — | — | |
| SCHEMBL12879764 | 0.71 | — | — | |
| SCHEMBL12879776 | 0.69 | — | — | |
| SCHEMBL9972654 | 0.69 | HTT (0.34) | — | |
| SCHEMBL6376992 | 0.67 | — | — | |
| SCHEMBL12879737 | 0.65 | — | — | |
| SCHEMBL2175641 | 0.63 | — | — | |
| SCHEMBL16270938 | 0.63 | — | — | |
| SCHEMBL12562460 | 0.63 | — | — |
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-2007039781-A2 | NEW COMPOUNDS | Richter Gedeon Vegyészeti Gyár Rt. (HU) | 2007-04-12 | — | — | WO | disclosed |