⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16326842 | 0.76 | — | — | |
| SCHEMBL10062393 | 0.76 | — | — | |
| SCHEMBL2590253 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL929923 | 0.67 | — | — | |
| SCHEMBL64855 | 0.65 | — | — | |
| SCHEMBL18989154 | 0.64 | NOS3 (0.42) | — | |
| SCHEMBL62597 | 0.64 | — | — | |
| SCHEMBL24915305 | 0.64 | — | — | |
| SCHEMBL4280209 | 0.63 | — | — | |
| SCHEMBL13041573 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016027844-A1 | TETRAHYDROIMIDAZO[1,5-d][1,4]OXAZEPINE COMPOUND | エーザイ・アール・アンド・ディー・マネジメント株式会社 | 2016-02-25 | — | — | WO | disclosed |