⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17096197 | 0.90 | — | — | |
| SCHEMBL17060164 | 0.89 | — | — | |
| SCHEMBL17096966 | 0.87 | NQO2 (0.30) | — | |
| SCHEMBL17096975 | 0.87 | — | — | |
| SCHEMBL17096826 | 0.86 | — | — | |
| SCHEMBL17060176 | 0.85 | PTGS1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL17060187 | 0.85 | — | — | |
| SCHEMBL17060143 | 0.82 | — | — | |
| SCHEMBL17096689 | 0.82 | — | — | |
| SCHEMBL17096973 | 0.81 | PTGS2 (0.31) | — |
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-9902749-B2 | Metallocene complex and olefin polymerization method | JAPAN POLYPROPYLENE CORPORATION (JP) | 2018-02-27 | — | — | US | disclosed |
| US-20150266914-A1 | METALLOCENE COMPLEX AND OLEFIN POLYMERIZATION METHOD | JAPAN POLYPROPYLENE CORPORATION (JP) | 2015-09-24 | — | — | US | disclosed |