⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4523228 | 0.83 | HPGD (0.32) | — | |
| SCHEMBL6484390 | 0.78 | MAPT (0.33) | — | |
| SCHEMBL6493274 | 0.77 | — | — | |
| SCHEMBL133553 | 0.75 | — | — | |
| SCHEMBL6483902 | 0.75 | POLB (0.31) | — | |
| SCHEMBL919443 | 0.75 | — | — | |
| SCHEMBL1006906 | 0.74 | KMT2A (0.31) | — | |
| SCHEMBL3697821 | 0.74 | — | — | |
| SCHEMBL1535724 | 0.74 | — | — | |
| SCHEMBL920630 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20050014916-A1 | Ruthenium complexes, process for preparation thereof, and processes for producing open-ring polymer of cycloolefins and hydrogenation products thereof by using the complex as catalyst | ZEON CORPORATION (JP) | 2005-01-20 | — | — | US | disclosed |