⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23104263 | 0.79 | GABRA1 (0.39) | — | |
| SCHEMBL9950734 | 0.79 | KCNJ5 (0.31) | — | |
| SCHEMBL3027232 | 0.63 | NPC1 (0.37) | — | |
| SCHEMBL23102794 | 0.61 | GABRA1 (0.40) | — | |
| SCHEMBL25045596 | 0.59 | — | — | |
| SCHEMBL25045604 | 0.56 | CYP1A2 (0.33) | — | |
| SCHEMBL24989428 | 0.56 | — | — | |
| SCHEMBL25045606 | 0.55 | KDM4E (0.32) | — | |
| SCHEMBL23679750 | 0.54 | PI4KA (0.35) | — | |
| SCHEMBL10138768 | 0.54 | ABL1 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20120165305-A1 | SUBSTITUTED IMIDAZOPYRIDAZINES AND BENZIMIDAZOLES AS INHIBITORS OF FGFR3 | INCYTE CORPORATION | 2012-06-28 | — | — | US | disclosed |