⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24202220 | 0.74 | TSHR (0.54) | — | |
| SCHEMBL18236175 | 0.71 | MAPT (0.46) | — | |
| SCHEMBL18236158 | 0.66 | CREBBP (0.61) | — | |
| SCHEMBL7537107 | 0.66 | PDGFRB (0.39) | — | |
| SCHEMBL1783525 | 0.64 | TSHR (0.47) | — | |
| SCHEMBL21362663 | 0.64 | — | — | |
| SCHEMBL84657 | 0.62 | — | — | |
| Iodide SCHEMBL31463955 | 0.61 | TSHR (0.44) | — | |
| SCHEMBL1360610 | 0.61 | RAPGEF4 (0.48) | — | |
| SCHEMBL13198271 | 0.61 | RAPGEF4 (0.42) | — |
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-3208269-A1 | INHIBITORS OF C-FMS KINASE | Janssen Pharmaceutica N.V. (BE) | 2017-08-23 | — | — | EP | disclosed |