⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7579320 | 0.96 | — | — | |
| SCHEMBL7575703 | 0.96 | — | — | |
| SCHEMBL7575252 | 0.95 | — | — | |
| SCHEMBL6470488 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL9068233 | 0.81 | — | — | |
| SCHEMBL7724781 | 0.75 | — | — | |
| Ethane SCHEMBL27413223 | 0.74 | — | — | |
| SCHEMBL9230177 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL2481792 | 0.73 | — | — | |
| SCHEMBL8835227 | 0.72 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20020019504-A1 | Stereospecific; low molecular weight | MITSUI CHEMICALS, INC. (JP) | 2002-02-14 | — | — | US | disclosed |
| US-6342568-B1 | ADDITION POLYMERIZATION OF HIGHLYS STEREOSPECIFIC AND LOW MOLECULAR WEIGHT POLYOLEFINS USING CATALYST COMPRISING CYCLOPENTADIENYL-SUBSTITUTED FLUORENE COMPOUND COMPLEXED WITH GROUP IV METAL | MITSUI CHEMICALS, INC. (JP) | 2002-01-29 | — | — | US | disclosed |
| EP-0955305-A1 | Metallocene compound, and process for preparing polyolefin by using it | Mitsui Chemicals, Inc. (JP) | 1999-11-10 | — | — | EP | disclosed |