⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8344721 | 0.73 | — | — | |
| SCHEMBL9935284 | 0.73 | — | — | |
| SCHEMBL24771044 | 0.67 | — | — | |
| SCHEMBL8744139 | 0.62 | — | — | |
| SCHEMBL18570283 | 0.62 | — | — | |
| SCHEMBL1759431 | 0.55 | — | — | |
| SCHEMBL15428127 | 0.55 | — | — | |
| SCHEMBL179255 | 0.55 | — | — | |
| SCHEMBL17194880 | 0.53 | — | — | |
| SCHEMBL10238317 | 0.53 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2290012-B1 | NANOSCALE PIGMENT PARTICLE COMPOSITION AND PROCESS FOR PRODUCING THE SAME | XEROX CORP (US) | 2017-10-18 | — | — | EP | disclosed |