⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1237467 | 1.00 | — | — | |
| SCHEMBL6852955 | 0.80 | — | — | |
| SCHEMBL6852952 | 0.80 | — | — | |
| SCHEMBL849090 | 0.78 | — | — | |
| SCHEMBL849091 | 0.78 | — | — | |
| SCHEMBL1078841 | 0.76 | — | — | |
| SCHEMBL848558 | 0.76 | — | — | |
| SCHEMBL1044847 | 0.75 | — | — | |
| SCHEMBL1044846 | 0.75 | — | — | |
| SCHEMBL8844869 | 0.75 | TSHR (0.35) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7879960-B2 | methyl)(phenyl)methylene(3-tert-butyl-5-ethylcyclopentadienyl)(3,6-di-tert-butylfluorenyl)zirconium dichloride a metallocene], methylalumoxane, triisobutylaluminum containing catalyst system for propylene homo or copolymerization | MITSUI CHEMICALS, INC. (JP) | 2011-02-01 | — | — | US | disclosed |
| EP-1803742-B1 | PROCESS FOR PRODUCING PROPYLENE POLYMER | MITSUI CHEMICALS INC (JP) | 2010-06-23 | — | — | EP | disclosed |
| US-20080097055-A1 | Process for Producing Propylene Polymer | MITSUI CHEMICALS, INC. (JP) | 2008-04-24 | — | — | US | disclosed |
| EP-1803742-A1 | PROCESS FOR PRODUCING PROPYLENE POLYMER | Mitsui Chemicals, Inc. (JP) | 2007-07-04 | — | — | EP | disclosed |