⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28421415 | 0.77 | — | — | |
| SCHEMBL28414171 | 0.72 | ANPEP (0.43) | — | |
| SCHEMBL5218509 | 0.72 | — | — | |
| SCHEMBL4066708 | 0.71 | — | — | |
| SCHEMBL2272090 | 0.67 | — | — | |
| SCHEMBL6246367 | 0.64 | ANPEP (0.60) | — | |
| SCHEMBL13645247 | 0.64 | — | — | |
| SCHEMBL17492163 | 0.61 | ANPEP (0.56) | — | |
| SCHEMBL28960012 | 0.61 | ANPEP (0.56) | — | |
| SCHEMBL28463686 | 0.61 | ANPEP (0.56) | — |
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-2004064755-A2 | METHODS FOR INHIBITING PROTEASOME | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-08-05 | — | — | WO | disclosed |