⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27366459 | 0.75 | TSHR (0.34) | — | |
| SCHEMBL27973162 | 0.73 | — | — | |
| Hydrogen Sulfide SCHEMBL28313069 | 0.72 | — | — | |
| Thiocyanic Acid SCHEMBL28003272 | 0.66 | — | — | |
| SCHEMBL27555900 | 0.66 | ALDH1A1 (0.31) | — | |
| SCHEMBL2492430 | 0.64 | — | — | |
| SCHEMBL27976408 | 0.63 | — | — | |
| SCHEMBL27550591 | 0.60 | — | — | |
| SCHEMBL27484788 | 0.60 | — | — | |
| SCHEMBL27921492 | 0.60 | — | — |
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-0430528-A1 | Lube oil additive package containing viscosity index improver | ETHYL PETROLEUM ADDITIVES, INC. (US) | 1991-06-05 | — | — | EP | disclosed |