⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL875020 | 0.67 | — | — | |
| SCHEMBL8966333 | 0.67 | — | — | |
| SCHEMBL15818182 | 0.64 | — | — | |
| SCHEMBL19018621 | 0.64 | — | — | |
| Methylsulfanylmethane SCHEMBL10613399 | 0.57 | — | — | |
| SCHEMBL13989214 | 0.55 | — | — | |
| SCHEMBL10339205 | 0.53 | — | — | |
| SCHEMBL16136856 | 0.53 | — | — | |
| SCHEMBL17454894 | 0.53 | — | — | |
| SCHEMBL3468223 | 0.53 | — | — |
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-2402419-B1 | METHOD FOR UPGRADING HYDROCARBON COMPOUND AND APPARATUS FOR SEPARATING HYDROCARBON COMPOUNDS BY DISTILLATION | JAPAN OIL GAS & METALS JOGMEC (JP) | 2016-06-22 | — | — | EP | disclosed |