⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4465241 | 0.98 | — | — | |
| Bromide SCHEMBL7889946 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL818104 | 0.74 | — | — | |
| Methyl Alcohol SCHEMBL7032978 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL4467249 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL4466015 | 0.70 | — | — | |
| SCHEMBL4463163 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL4889322 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL4565009 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL4095943 | 0.62 | — | — |
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-1880986-B1 | PROCESS FOR PRODUCING SATURATED ALIPHATIC HYDROCARBONS, AND LUBRICANT COMPOSITIONS THEREOF | IDEMITSU KOSAN CO (JP) | 2013-03-06 | — | — | EP | disclosed |