⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29536067 | 1.00 | — | — | |
| SCHEMBL23670126 | 0.90 | — | — | |
| SCHEMBL23669550 | 0.90 | — | — | |
| SCHEMBL5028537 | 0.80 | FKBP1A (0.31) | — | |
| SCHEMBL5028539 | 0.80 | FKBP1A (0.31) | — | |
| SCHEMBL21906244 | 0.80 | — | — | |
| SCHEMBL14987109 | 0.80 | USP2 (0.42) | — | |
| SCHEMBL14987412 | 0.80 | USP2 (0.42) | — | |
| SCHEMBL924141 | 0.80 | USP2 (0.42) | — | |
| SCHEMBL28616315 | 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 |
|---|---|---|---|---|---|---|---|
| EP-3864020-A1 | MACROCYCLIC FLU ENDONUCLEASE INHIBITORS | Janssen BioPharma, Inc. (US) | 2021-08-18 | — | — | EP | disclosed |