⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL912234 | 0.82 | — | — | |
| SCHEMBL78997 | 0.79 | — | — | |
| SCHEMBL6716393 | 0.71 | — | — | |
| SCHEMBL10427361 | 0.60 | — | — | |
| SCHEMBL5427582 | 0.60 | — | — | |
| SCHEMBL10427580 | 0.59 | — | — | |
| SCHEMBL10427694 | 0.59 | — | — | |
| SCHEMBL135576 | 0.56 | — | — | |
| SCHEMBL9248376 | 0.55 | — | — | |
| SCHEMBL969860 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6110549-A | HIGH DENSITY POLYETHYLENE AND A LINEAR LOW DENSITY POLYETHYLENE MADE WITH METALLOCENE CATALYST; SEALANT FILM RESISTANT TO WHITENING, HEAT DEFORMATION AFTER BOILING STERILIZATION, AND HAS HIGH IMPACT STRENGTH | MITSUI CHEMICALS INC. (JP) | 2000-08-29 | — | — | US | disclosed |