⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4267233 | 0.89 | — | — | |
| SCHEMBL1955259 | 0.80 | — | — | |
| SCHEMBL1956700 | 0.80 | — | — | |
| SCHEMBL10443080 | 0.80 | — | — | |
| SCHEMBL7899380 | 0.80 | — | — | |
| SCHEMBL9309222 | 0.78 | — | — | |
| SCHEMBL8560671 | 0.78 | — | — | |
| SCHEMBL8087341 | 0.73 | — | — | |
| SCHEMBL9720289 | 0.73 | — | — | |
| SCHEMBL14152514 | 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-5646097-A | Method of fabricating a (1223) Tl-Ba-Ca-Cu-O superconductor | GENERAL ELECTRIC COMPANY (US) | 1997-07-08 | — | — | US | claimed |