⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18858707 | 0.83 | — | — | |
| SCHEMBL17340864 | 0.82 | — | — | |
| SCHEMBL28996191 | 0.80 | — | — | |
| SCHEMBL7056442 | 0.80 | — | — | |
| SCHEMBL18160206 | 0.80 | — | — | |
| SCHEMBL677691 | 0.79 | — | — | |
| SCHEMBL6669154 | 0.75 | — | — | |
| SCHEMBL16812713 | 0.74 | — | — | |
| SCHEMBL12873464 | 0.72 | — | — | |
| SCHEMBL17340865 | 0.71 | — | — |
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-9649834-B1 | Stabilizers against toxic emissions in imaging plate or intermediate blanket materials | XEROX CORPORATION (US) | 2017-05-16 | — | — | US | disclosed |