⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20841646 | 0.69 | — | — | |
| SCHEMBL20998511 | 0.69 | — | — | |
| SCHEMBL21003971 | 0.69 | — | — | |
| SCHEMBL7475808 | 0.67 | — | — | |
| SCHEMBL24387088 | 0.63 | — | — | |
| SCHEMBL21003609 | 0.63 | — | — | |
| SCHEMBL19113371 | 0.63 | — | — | |
| SCHEMBL21389783 | 0.63 | — | — | |
| SCHEMBL17429774 | 0.62 | — | — | |
| SCHEMBL456912 | 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 |
|---|---|---|---|---|---|---|---|
| EP-2822953-B1 | MACROCYCLIC DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE DISEASES | PFIZER (US) | 2017-02-01 | — | — | EP | disclosed |