⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6364071 | 1.00 | — | — | |
| SCHEMBL11911868 | 0.91 | — | — | |
| SCHEMBL24255370 | 0.91 | — | — | |
| SCHEMBL24575066 | 0.91 | — | — | |
| SCHEMBL13992795 | 0.91 | — | — | |
| SCHEMBL24342638 | 0.91 | — | — | |
| SCHEMBL24574929 | 0.91 | — | — | |
| SCHEMBL12216090 | 0.88 | — | — | |
| SCHEMBL13992796 | 0.88 | — | — | |
| SCHEMBL8259534 | 0.86 | MET (0.30) | — |
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-20050143427-A1 | [B]-fused bicyclic proline derivatives and their use for treating arthritic conditions | BARVIAN NICOLE C (US) | 2005-06-30 | — | — | US | disclosed |