⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20093396 | 0.80 | — | — | |
| SCHEMBL24377323 | 0.75 | — | — | |
| SCHEMBL19965999 | 0.72 | CYP2D6 (0.34) | — | |
| SCHEMBL24498747 | 0.72 | — | — | |
| SCHEMBL19007320 | 0.71 | — | — | |
| SCHEMBL23183148 | 0.71 | — | — | |
| SCHEMBL10704852 | 0.71 | — | — | |
| SCHEMBL26842041 | 0.71 | — | — | |
| SCHEMBL22595045 | 0.69 | KDM4E (0.37) | — | |
| SCHEMBL840274 | 0.69 | KAT2B (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022086920-A1 | GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE LIKE (QPCTL) PROTEIN INHIBITORS AND USES THEREOF | BLACKSMITH MEDICINES, INC. (US) | 2022-04-28 | — | — | WO | disclosed |