⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22812219 | 0.85 | — | — | |
| SCHEMBL20154515 | 0.71 | DRD2 (0.33) | — | |
| SCHEMBL20153208 | 0.71 | SPR (0.32) | — | |
| SCHEMBL20160376 | 0.70 | — | — | |
| SCHEMBL27286645 | 0.70 | DPP4 (0.33) | — | |
| SCHEMBL19567290 | 0.70 | SPR (0.32) | — | |
| SCHEMBL19013696 | 0.69 | HRH3 (0.32) | — | |
| SCHEMBL20962676 | 0.69 | ALDH1A1 (0.33) | — | |
| SCHEMBL20148595 | 0.68 | — | — | |
| SCHEMBL23903141 | 0.68 | DNM1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180133200-A1 | SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS | ARRAY BIOPHARMA INC. | 2018-05-17 | — | — | US | disclosed |