⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21406942 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL18632195 | 0.96 | — | — | |
| SCHEMBL21406947 | 0.94 | — | — | |
| SCHEMBL6047549 | 0.89 | — | — | |
| SCHEMBL14735504 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL18632186 | 0.88 | — | — | |
| SCHEMBL21406908 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL18632105 | 0.88 | — | — | |
| SCHEMBL4504371 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL18632122 | 0.88 | — | — |
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-2275451-B1 | Method for producing propylene-based copolymer | MITSUI CHEMICALS INC (JP) | 2016-10-19 | — | — | EP | disclosed |