⚠ 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 SCHEMBL4467082 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL648943 | 0.98 | — | — | |
| SCHEMBL9069161 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL7185830 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL8432265 | 0.97 | — | — | |
| Biphenyl SCHEMBL7185806 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL439588 | 0.82 | — | — | |
| SCHEMBL4351030 | 0.80 | — | — | |
| SCHEMBL2193996 | 0.78 | — | — | |
| Methane SCHEMBL5838941 | 0.78 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1880986-A1 | PROCESS FOR PRODUCING SATURATED ALIPHATIC HYDROCARBON COMPOUND, AND LUBRICANT COMPOSITION | IDEMITSU KOSAN CO., LTD. (JP) | 2008-01-23 | — | — | EP | disclosed |
| US-5444125-A | Having excellent adhesion, printability, compatibility in blends | MITSUBISHI PETROCHEMICAL COMPANY LIMITED (JP) | 1995-08-22 | — | — | US | disclosed |