⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11744611 | 0.68 | — | — | |
| SCHEMBL262126 | 0.68 | — | — | |
| SCHEMBL13626381 | 0.68 | — | — | |
| SCHEMBL2302701 | 0.68 | — | — | |
| SCHEMBL266562 | 0.68 | — | — | |
| SCHEMBL24749624 | 0.68 | — | — | |
| SCHEMBL24583972 | 0.67 | — | — | |
| SCHEMBL25093088 | 0.64 | L3MBTL1 (0.34) | — | |
| SCHEMBL11491480 | 0.62 | — | — | |
| SCHEMBL9881327 | 0.61 | — | — |
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-2418213-A1 | NEUROMEDIN U DERIVATIVE | Takeda Pharmaceutical Company Limited (JP) | 2012-02-15 | — | — | EP | disclosed |