⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4949188 | 0.76 | — | — | |
| SCHEMBL9483749 | 0.72 | KDM4E (0.35) | — | |
| SCHEMBL10905436 | 0.68 | — | — | |
| SCHEMBL23737798 | 0.67 | — | — | |
| SCHEMBL28029072 | 0.65 | — | — | |
| SCHEMBL16066065 | 0.65 | — | — | |
| SCHEMBL4105321 | 0.63 | — | — | |
| SCHEMBL30539477 | 0.62 | — | — | |
| SCHEMBL28728338 | 0.62 | — | — | |
| SCHEMBL153237 | 0.61 | — | — |
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-3862023-A1 | CONJUGATES OF CELL-BINDING MOLECULES WITH CYTOTOXIC AGENTS | Hangzhou DAC Biotech Co, Ltd (CN) | 2021-08-11 | — | — | EP | disclosed |