⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2801960 | 0.69 | — | — | |
| SCHEMBL3889960 | 0.67 | — | — | |
| SCHEMBL2768575 | 0.65 | — | — | |
| SCHEMBL21918107 | 0.65 | — | — | |
| SCHEMBL1275579 | 0.63 | — | — | |
| SCHEMBL5253 | 0.63 | — | — | |
| Ammonia Solution, Strong SCHEMBL23674462 | 0.60 | — | — | |
| SCHEMBL12949767 | 0.59 | — | — | |
| SCHEMBL12626371 | 0.59 | — | — | |
| SCHEMBL20189852 | 0.59 | — | — |
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 |