⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6673068 | 0.76 | — | — | |
| SCHEMBL27473581 | 0.69 | HTR2A (0.33) | — | |
| SCHEMBL4652363 | 0.68 | HTR2A (0.37) | — | |
| SCHEMBL6675929 | 0.68 | HTR2A (0.37) | — | |
| SCHEMBL1454026 | 0.68 | — | — | |
| SCHEMBL9146450 | 0.67 | HTR2A (0.36) | — | |
| SCHEMBL9141951 | 0.67 | HTR2A (0.36) | — | |
| SCHEMBL15864111 | 0.67 | — | — | |
| SCHEMBL4653659 | 0.67 | HTR2A (0.38) | — | |
| SCHEMBL4652448 | 0.67 | HTR2A (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0693497-A2 | Process for the preparation of silicon-bridged asymmetric cyclopentadienyl-, indenyl- and fluorenyl-containing ligand systems | PCD-Polymere Gesellschaft m.b.H. (AT) | 1996-01-24 | — | — | EP | disclosed |