⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14114635 | 0.73 | — | — | |
| SCHEMBL14183388 | 0.68 | — | — | |
| SCHEMBL14183529 | 0.68 | — | — | |
| SCHEMBL14183377 | 0.68 | — | — | |
| SCHEMBL14183263 | 0.67 | — | — | |
| SCHEMBL14183518 | 0.65 | — | — | |
| SCHEMBL14183555 | 0.65 | — | — | |
| SCHEMBL14967806 | 0.64 | CYP3A4 (0.34) | — | |
| SCHEMBL14183511 | 0.62 | — | — | |
| SCHEMBL9502589 | 0.62 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5128431-A | Curable | GENERAL ELECTRIC COMPANY (US) | 1992-07-07 | — | — | US | disclosed |
| EP-0415243-A2 | Platinum catalyzed heterocyclic compound compositions | GENERAL ELECTRIC COMPANY (US) | 1991-03-06 | — | — | EP | disclosed |