⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2556789 | 0.62 | — | — | |
| SCHEMBL18257918 | 0.60 | — | — | |
| Water SCHEMBL4246169 | 0.60 | — | — | |
| Bromide SCHEMBL28103692 | 0.60 | — | — | |
| Propane SCHEMBL28242754 | 0.60 | — | — | |
| SCHEMBL1488388 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL6188329 | 0.60 | — | — | |
| SCHEMBL469712 | 0.60 | — | — | |
| SCHEMBL17743328 | 0.57 | — | — | |
| SCHEMBL21695249 | 0.57 | — | — |
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-2012028448-A1 | PROCESS FOR APPLYING A BONDING LAYER TO A METALLIC SUBSTRATE | AKTIEBOLAGET SKF (SE) | 2012-03-08 | — | — | WO | claimed |