⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9792185 | 0.89 | BRD4 (0.47) | — | |
| SCHEMBL9792194 | 0.86 | ALDH1A1 (0.39) | — | |
| SCHEMBL9792209 | 0.84 | — | — | |
| SCHEMBL9792182 | 0.79 | BRD4 (0.51) | — | |
| SCHEMBL9792170 | 0.78 | ALDH1A1 (0.39) | — | |
| SCHEMBL10573409 | 0.76 | — | — | |
| SCHEMBL9692103 | 0.74 | — | — | |
| SCHEMBL9792188 | 0.74 | BRD4 (0.46) | — | |
| Methane SCHEMBL10387026 | 0.73 | — | — | |
| SCHEMBL9693467 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5066654-A | 2-aryl-3-heterocyclicmethyl-3H-imidazo[4,5-b]pyridines as anxiolytics and anticonvulsants | A. H. ROBINS COMPANY, INCORPORATED (US) | 1991-11-19 | — | — | US | claimed |
| US-5066654-A | 2-aryl-3-heterocyclicmethyl-3H-imidazo[4,5-b]pyridines as anxiolytics and anticonvulsants | A. H. ROBINS COMPANY, INCORPORATED (US) | 1991-11-19 | — | — | US | disclosed |