⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL891713 | 0.77 | — | — | |
| SCHEMBL19443254 | 0.75 | — | — | |
| SCHEMBL14887224 | 0.74 | CA12 (0.35) | — | |
| SCHEMBL24671553 | 0.73 | — | — | |
| SCHEMBL1816228 | 0.73 | — | — | |
| SCHEMBL16143172 | 0.70 | HSD17B10 (0.32) | — | |
| SCHEMBL892368 | 0.69 | — | — | |
| SCHEMBL21110911 | 0.67 | TSHR (0.32) | — | |
| SCHEMBL8087707 | 0.67 | — | — | |
| SCHEMBL24444757 | 0.67 | — | — |
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-2717916-B1 | PROTEIN-POLYMER-DRUG CONJUGATES | MERSANA THERAPEUTICS INC (US) | 2017-03-08 | — | — | EP | disclosed |