⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8702181 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL22093402 | 0.73 | — | — | |
| SCHEMBL15364814 | 0.71 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL3567307 | 0.71 | — | — | |
| SCHEMBL6688082 | 0.70 | MEN1 (0.32) | — | |
| SCHEMBL738320 | 0.67 | — | — | |
| SCHEMBL105840 | 0.67 | — | — | |
| SCHEMBL8431381 | 0.67 | HRH3 (0.33) | — | |
| SCHEMBL5595823 | 0.67 | THRB (0.31) | — | |
| SCHEMBL8706192 | 0.66 | HPGD (0.32) | — |
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-1827434-A2 | QUINOLINES AND QUINAZOLINE ANALOGS AND THEIR USE AS MEDICAMENTS FOR TREATING CANCER | Amgen Inc. (US) | 2007-09-05 | — | — | EP | claimed |
| WO-2006060318-A2 | QUINOLINES AND QUINAZOLINE ANALOGS AND THEIR USE AS MEDICAMENTS FOR TREATING CANCER | AMGEN INC. (US) | 2006-06-08 | — | — | WO | claimed |