⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21288010 | 0.85 | THRA (0.38) | — | |
| SCHEMBL9595445 | 0.82 | — | — | |
| SCHEMBL22959617 | 0.76 | — | — | |
| SCHEMBL21933618 | 0.76 | — | — | |
| SCHEMBL10202604 | 0.76 | — | — | |
| SCHEMBL17927979 | 0.76 | CYP19A1 (0.33) | — | |
| SCHEMBL22520541 | 0.72 | CYP1A2 (0.39) | — | |
| SCHEMBL10407082 | 0.71 | LIPA (0.30) | — | |
| SCHEMBL21288154 | 0.71 | — | — | |
| SCHEMBL20730604 | 0.71 | — | — |
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-20180064819-A1 | Targeting Ligands | SIXTH STREETLENDING PARTNERS, AS THE ADMINISTRATIVE AGENT | 2018-03-08 | — | — | US | disclosed |