⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26833120 | 0.81 | GAA (0.39) | — | |
| SCHEMBL26670519 | 0.77 | MAPT (0.31) | — | |
| SCHEMBL26670546 | 0.73 | POLB (0.39) | — | |
| SCHEMBL26670550 | 0.73 | METAP2 (0.33) | — | |
| SCHEMBL26833123 | 0.72 | DUT (0.30) | — | |
| SCHEMBL31604516 | 0.71 | MAPK14 (0.33) | — | |
| SCHEMBL22164548 | 0.71 | STAT3 (0.32) | — | |
| SCHEMBL318739 | 0.66 | CCR2 (0.35) | — | |
| SCHEMBL16908818 | 0.66 | — | — | |
| SCHEMBL31663317 | 0.65 | CYP2D6 (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 |
|---|---|---|---|---|---|---|---|
| WO-2023230542-A2 | PYRAZOLO[1,5-a]PYRIDINE DERIVATIVES FOR TREATING TRPM3-MEDIATED DISORDERS | KATHOLIEKE UNIVERSITEIT LEUVEN (BE) | 2023-11-30 | — | — | WO | disclosed |
| WO-2023230543-A1 | INDOLIZINE DERIVATIVES FOR TREATING TRPM3-MEDIATED DISORDERS | KATHOLIEKE UNIVERSITEIT LEUVEN (BE) | 2023-11-30 | — | — | WO | disclosed |