⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28056674 | 0.96 | LMNA (0.32) | — | |
| Hydrochloric Acid SCHEMBL2769509 | 0.94 | DRD2 (0.32) | — | |
| SCHEMBL27477094 | 0.85 | ALDH1A1 (0.32) | — | |
| Chloromethane SCHEMBL8149605 | 0.77 | LMNA (0.31) | — | |
| Chloromethane SCHEMBL8162509 | 0.75 | — | — | |
| SCHEMBL7526859 | 0.74 | LMNA (0.32) | — | |
| SCHEMBL27519902 | 0.74 | LMNA (0.32) | — | |
| SCHEMBL7907637 | 0.73 | ALDH1A1 (0.31) | — | |
| SCHEMBL28056580 | 0.73 | CDC25A (0.32) | — | |
| Chloromethane SCHEMBL3686216 | 0.73 | LMNA (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0716092-B1 | Organic transition metal compound and process for the preparation of polyolefin using same | TOSOH CORP (JP) | 2000-10-25 | — | — | EP | disclosed |
| US-5770666-A | METALLOCENE | TOSOH CORPORATION (JP) | 1998-06-23 | — | — | US | disclosed |
| EP-0716092-A1 | Organic transition metal compound and process for the preparation of polyolefin using same | TOSOH CORPORATION (JP) | 1996-06-12 | — | — | EP | disclosed |