⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7328700 | 0.67 | — | — | |
| SCHEMBL851188 | 0.66 | TSHR (0.30) | — | |
| SCHEMBL15327853 | 0.61 | KDM4E (0.30) | — | |
| SCHEMBL9468749 | 0.56 | — | — | |
| SCHEMBL19266147 | 0.52 | — | — | |
| SCHEMBL8993988 | 0.48 | — | — | |
| SCHEMBL119955 | 0.47 | — | — | |
| SCHEMBL7981543 | 0.47 | — | — | |
| Propiolactone SCHEMBL10680620 | 0.45 | — | — | |
| SCHEMBL42430 | 0.45 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991002084-A1 | METHOD FOR DETECTION AND TREATMENT OF MULTIPLE DRUG-RESISTANT TUMOR CELLS AND USEFUL COLCHICINE DERIVATIVE PROBES | MICHAEL REESE HOSPITAL AND MEDICAL CENTER (US) | 1991-02-21 | — | — | WO | disclosed |