⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19320442 | 1.00 | — | — | |
| SCHEMBL19320433 | 0.91 | — | — | |
| SCHEMBL19320440 | 0.90 | — | — | |
| SCHEMBL12708582 | 0.87 | CA2 (0.33) | — | |
| SCHEMBL19325120 | 0.84 | TSHR (0.31) | — | |
| SCHEMBL20332237 | 0.84 | TSHR (0.31) | — | |
| SCHEMBL14286687 | 0.84 | TSHR (0.31) | — | |
| SCHEMBL21534709 | 0.84 | — | — | |
| SCHEMBL31329388 | 0.78 | — | — | |
| SCHEMBL18112477 | 0.78 | — | — |
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-20170253875-A1 | Targeting Ligands For Therapeutic Compounds | SIXTH STREETLENDING PARTNERS, AS THE ADMINISTRATIVE AGENT | 2017-09-07 | — | — | US | disclosed |