⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24407896 | 1.00 | — | — | |
| SCHEMBL15710652 | 1.00 | — | — | |
| SCHEMBL24407905 | 0.79 | MEN1 (0.34) | — | |
| SCHEMBL28275466 | 0.79 | FAAH (0.42) | — | |
| SCHEMBL2349984 | 0.78 | — | — | |
| SCHEMBL22739266 | 0.78 | — | — | |
| SCHEMBL5693334 | 0.77 | MAPK1 (0.33) | — | |
| SCHEMBL7743902 | 0.77 | CRBN (0.42) | — | |
| SCHEMBL1346930 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL28058495 | 0.74 | ALDH1A1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109384687-A | Polymerism photosensitive monomer and preparation method thereof with include its photocuring system | 江苏百赛飞生物科技有限公司 | 2019-02-26 | — | — | CN | disclosed |
| US-20160257686-A1 | Purinone Derivatives as Tyrosine Kinase Inhibitors | PRINCIPIA BIOPHARMA INC. (US) | 2016-09-08 | — | — | US | disclosed |
| US-20140142099-A1 | Purinone Derivatives as Tyrosine Kinase Inhibitors | PRINCIPIA BIOPHARMA INC. (US) | 2014-05-22 | — | — | US | disclosed |