⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12869962 | 0.72 | — | — | |
| SCHEMBL27111882 | 0.67 | — | — | |
| SCHEMBL24492259 | 0.67 | — | — | |
| SCHEMBL13694584 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL27874947 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL28313892 | 0.65 | — | — | |
| SCHEMBL24660161 | 0.63 | — | — | |
| SCHEMBL24538130 | 0.63 | — | — | |
| SCHEMBL10016100 | 0.63 | — | — | |
| SCHEMBL4019525 | 0.62 | — | — |
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-20210299271-A1 | CONJUGATES COMPRISING CELL-BINDING AGENTS AND CYTOTOXIC AGENTS | IMMUNOGEN, INC. | 2021-09-30 | — | — | US | disclosed |