⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4208469 | 0.81 | — | — | |
| SCHEMBL4212430 | 0.76 | — | — | |
| SCHEMBL4209684 | 0.74 | — | — | |
| SCHEMBL888520 | 0.74 | — | — | |
| SCHEMBL233773 | 0.74 | TSHR (0.35) | — | |
| SCHEMBL4199464 | 0.71 | EPHX1 (0.34) | — | |
| SCHEMBL4212582 | 0.71 | ACHE (0.31) | — | |
| SCHEMBL4207775 | 0.70 | EPHX1 (0.37) | — | |
| SCHEMBL235790 | 0.67 | — | — | |
| SCHEMBL234781 | 0.67 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090253873-A1 | SOLID CATALYST COMPONENT AND CATALYST FOR POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING POLYMER OR COPOLYMER OF OLEFIN USING THE SAME | TOHO CATALYST CO., LTD (JP) | 2009-10-08 | — | — | US | disclosed |
| EP-1829898-A1 | SOLID CATALYST COMPONENT AND CATALYST FOR POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING POLYMER OR COPOLYMER OF OLEFIN USING THE SAME | Toho Catalyst Co., Ltd. (JP) | 2007-09-05 | — | — | EP | disclosed |