⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13718988 | 0.71 | — | — | |
| SCHEMBL8985642 | 0.69 | — | — | |
| SCHEMBL1924525 | 0.67 | LMNA (0.44) | — | |
| SCHEMBL8536846 | 0.67 | — | — | |
| SCHEMBL8620304 | 0.65 | — | — | |
| SCHEMBL27603680 | 0.65 | LMNA (0.41) | — | |
| SCHEMBL9747332 | 0.65 | LMNA (0.41) | — | |
| SCHEMBL2444108 | 0.63 | — | — | |
| SCHEMBL27756667 | 0.63 | — | — | |
| SCHEMBL220078 | 0.63 | — | — |
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-1411993-B1 | RADIOLABELED IRREVERSIBLE INHIBITORS OF EPIDERMAL GROWTH FACTOR RECEPTOR TYROSINE KINASE AND THEIR USE IN RADIOIMAGING AND RADIOTHERAPY | YISSUM RES DEV CO (IL) | 2010-05-05 | — | — | EP | disclosed |