⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18240580 | 0.92 | — | — | |
| SCHEMBL18240476 | 0.85 | — | — | |
| SCHEMBL1076931 | 0.84 | — | — | |
| SCHEMBL18240643 | 0.83 | ALDH1A1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL5986238 | 0.75 | — | — | |
| SCHEMBL14735606 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL2869103 | 0.72 | — | — | |
| SCHEMBL4952158 | 0.71 | MEN1 (0.31) | — | |
| SCHEMBL4953467 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL5984585 | 0.70 | — | — |
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-1900758-A1 | CATALYST FOR OLEFIN POLYMERIZATION, METHOD FOR PRODUCING OLEFIN POLYMER, METHOD FOR PRODUCING PROPYLENE COPOLYMER, PROPYLENE POLYMER, PROPYLENE POLYMER COMPOSITION, AND USE OF THOSE | Mitsui Chemicals, Inc. (JP) | 2008-03-19 | — | — | EP | disclosed |