⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12308814 | 0.69 | — | — | |
| SCHEMBL6519691 | 0.58 | — | — | |
| SCHEMBL12985568 | 0.57 | — | — | |
| SCHEMBL21894269 | 0.54 | — | — | |
| SCHEMBL954877 | 0.45 | — | — | |
| Benzene SCHEMBL271140 | 0.42 | — | — | |
| Methylene Chloride SCHEMBL1154217 | 0.42 | — | — | |
| Methylene Chloride SCHEMBL18247337 | 0.42 | — | — | |
| Methylene Chloride SCHEMBL1332597 | 0.42 | — | — | |
| Methylene Chloride SCHEMBL7293016 | 0.42 | — | — |
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-7402707-B2 | Method of preparation of a precursor oligocene | KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) | 2008-07-22 | — | — | US | disclosed |
| US-7402707-B2 | Method of preparation of a precursor oligocene | KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) | 2008-07-22 | — | — | US | disclosed |