⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4209589 | 0.86 | — | — | |
| SCHEMBL4208469 | 0.85 | — | — | |
| SCHEMBL4207836 | 0.83 | — | — | |
| SCHEMBL4217487 | 0.78 | — | — | |
| SCHEMBL4208276 | 0.76 | — | — | |
| SCHEMBL4213243 | 0.75 | ACHE (0.32) | — | |
| SCHEMBL4216628 | 0.74 | CYP1A2 (0.33) | — | |
| SCHEMBL4212204 | 0.73 | EPHX1 (0.34) | — | |
| SCHEMBL4216995 | 0.71 | HSD17B10 (0.30) | — | |
| SCHEMBL4207170 | 0.71 | — | — |
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 |