⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5974614 | 0.96 | TYR (0.34) | — | |
| SCHEMBL5974519 | 0.95 | TYR (0.36) | — | |
| SCHEMBL5974781 | 0.92 | — | — | |
| SCHEMBL5974993 | 0.87 | — | — | |
| SCHEMBL5974234 | 0.84 | — | — | |
| SCHEMBL1239968 | 0.82 | — | — | |
| SCHEMBL5975161 | 0.81 | — | — | |
| SCHEMBL390007 | 0.80 | — | — | |
| SCHEMBL8359400 | 0.80 | — | — | |
| SCHEMBL5974682 | 0.80 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1209165-B1 | Propylene elastomer | MITSUI CHEMICALS INC (JP) | 2006-04-19 | — | — | EP | disclosed |
| EP-1209165-A2 | Novel transition metal compound for use as a polymerisation caltalyst | Mitsui Chemicals, Inc. (JP) | 2002-05-29 | — | — | EP | disclosed |
| US-5767033-A | METALLOCENES | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1998-06-16 | — | — | US | disclosed |
| US-5739366-A | Transition metal compound containing substituted indenyl rings | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1998-04-14 | — | — | US | disclosed |
| US-5504172-A | COORDINATION CATALYST | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1996-04-02 | — | — | US | disclosed |
| EP-0629631-A2 | Novel transition metal compound, and polymerization catalyst containing it | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1994-12-21 | — | — | EP | disclosed |