⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12005309 | 0.67 | — | — | |
| SCHEMBL11900027 | 0.65 | — | — | |
| SCHEMBL16667542 | 0.62 | — | — | |
| SCHEMBL7094129 | 0.60 | — | — | |
| SCHEMBL1053219 | 0.57 | — | — | |
| SCHEMBL17729873 | 0.56 | — | — | |
| SCHEMBL15328675 | 0.55 | — | — | |
| SCHEMBL3952434 | 0.55 | — | — | |
| SCHEMBL1053548 | 0.52 | — | — | |
| SCHEMBL144415 | 0.52 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008063134-A1 | METHOD OF PRODUCING A PATTERN OF DISCRIMINATIVE WETTABILITY | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2008-05-29 | — | — | WO | disclosed |