⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4916713 | 0.67 | — | — | |
| SCHEMBL7947882 | 0.62 | — | — | |
| SCHEMBL3249847 | 0.51 | — | — | |
| SCHEMBL389120 | 0.42 | — | — | |
| SCHEMBL28225821 | 0.41 | INMT (0.39) | — | |
| SCHEMBL28430569 | 0.41 | — | — | |
| SCHEMBL27721688 | 0.40 | — | — | |
| Hydrochloric Acid SCHEMBL28032436 | 0.40 | — | — | |
| SCHEMBL1797068 | 0.40 | — | — | |
| SCHEMBL9549440 | 0.40 | INMT (0.37) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001053361-A1 | SILOXY-SUBSTITUTED MONOCYCLOPENTADIENYL LIGATED CONSTRAINED GEOMETRY OLEFIN POLYMERISATION CATALYSTS | BOREALIS TECHNOLOGY OY (FI) | 2001-07-26 | — | — | WO | disclosed |