⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5597350 | 0.87 | — | — | |
| SCHEMBL8024846 | 0.81 | — | — | |
| SCHEMBL6559823 | 0.75 | — | — | |
| SCHEMBL7548281 | 0.72 | — | — | |
| SCHEMBL6451171 | 0.72 | — | — | |
| SCHEMBL4577131 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL2484556 | 0.71 | — | — | |
| Fluoride SCHEMBL1131398 | 0.71 | — | — | |
| SCHEMBL6652034 | 0.71 | — | — | |
| SCHEMBL566019 | 0.69 | GPR3 (0.34) | — |
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-0798306-B1 | Substituted indenyl unbridged metallocenes | PHILLIPS PETROLEUM CO (US) | 2002-05-22 | — | — | EP | claimed |