⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10395834 | 0.95 | — | — | |
| SCHEMBL30601598 | 0.92 | — | — | |
| SCHEMBL9818279 | 0.82 | — | — | |
| SCHEMBL11033598 | 0.81 | — | — | |
| SCHEMBL28077738 | 0.81 | — | — | |
| SCHEMBL4176778 | 0.79 | — | — | |
| SCHEMBL4607312 | 0.77 | — | — | |
| SCHEMBL9865233 | 0.76 | — | — | |
| SCHEMBL6053171 | 0.70 | — | — | |
| SCHEMBL3370457 | 0.67 | — | — |
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-20100190688-A1 | Tetrapeptide analogs | IDUN PHARMACEUTICALS, INC. | 2010-07-29 | — | — | US | disclosed |