⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10863592 | 0.70 | KDM4E (0.31) | — | |
| SCHEMBL10862657 | 0.69 | GAA (0.33) | — | |
| SCHEMBL31250320 | 0.69 | KDM4E (0.30) | — | |
| SCHEMBL31250299 | 0.69 | KDM4E (0.30) | — | |
| SCHEMBL31250297 | 0.66 | — | — | |
| SCHEMBL15515898 | 0.65 | — | — | |
| SCHEMBL24176110 | 0.64 | SOS1 (0.32) | — | |
| SCHEMBL15388721 | 0.63 | — | — | |
| SCHEMBL15388950 | 0.63 | — | — | |
| SCHEMBL659964 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2892892-A1 | IMIDAZOLIN-5-ONE DERIVATIVES USEFUL AS FATTY ACID SNTHASE (FASN) INHIBITORS FOR!THE TREATMENT OF CANCER | Janssen Pharmaceutica N.V. (BE) | 2015-07-15 | — | — | EP | disclosed |
| WO-2014039769-A1 | IMIDAZOLIN-5-ONE DERIVATIVES USEFUL AS FATTY ACID SNTHASE (FASN) INHIBITORS FOR|THE TREATMENT OF CANCER | JANSSEN PHARMACEUTICA NV (BE) | 2014-03-13 | — | — | WO | disclosed |