⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13257940 | 1.00 | — | — | |
| SCHEMBL10023140 | 1.00 | — | — | |
| SCHEMBL14601488 | 1.00 | — | — | |
| SCHEMBL26991755 | 0.81 | — | — | |
| SCHEMBL9888337 | 0.79 | — | — | |
| SCHEMBL12997179 | 0.79 | — | — | |
| SCHEMBL18006644 | 0.79 | — | — | |
| SCHEMBL10030209 | 0.75 | — | — | |
| SCHEMBL18767035 | 0.75 | — | — | |
| SCHEMBL10023138 | 0.75 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070015260-A1 | Synthesis of synthons for the manufacture of bioactive compounds | DIVERSA CORPORATION | 2007-01-18 | — | — | US | disclosed |
| US-20070015260-A1 | Synthesis of synthons for the manufacture of bioactive compounds | DIVERSA CORPORATION | 2007-01-18 | — | — | US | disclosed |