⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL184709 | 0.81 | — | — | |
| SCHEMBL9936963 | 0.77 | — | — | |
| SCHEMBL28272852 | 0.77 | — | — | |
| SCHEMBL17872245 | 0.77 | SMN1; SMN2 (0.38) | — | |
| Methylamine SCHEMBL28435419 | 0.75 | ALDH1A1 (0.39) | — | |
| SCHEMBL5310436 | 0.75 | — | — | |
| SCHEMBL5310441 | 0.75 | — | — | |
| SCHEMBL28594 | 0.75 | — | — | |
| SCHEMBL5314742 | 0.75 | — | — | |
| SCHEMBL8918976 | 0.74 | CYP4F2 (0.38) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113891882-B | Process for producing dihydroisoxazole | 组合化学工业株式会社 | 2024-11-26 | — | — | CN | disclosed |
| CN-113891882-A | Method for producing dihydroisoxazole | 组合化学工业株式会社 | 2022-01-04 | — | — | CN | disclosed |
| WO-2020251006-A1 | METHOD FOR PRODUCING DIHYDROISOXAZOLE | クミアイ化学工業株式会社 | 2020-12-17 | — | — | WO | disclosed |
| EP-1057823-B1 | Process for producing 3-methyltetrahydrofuran | KURARAY CO (JP) | 2005-09-21 | — | — | EP | disclosed |
| US-6239295-B1 | Process for producing 3-methyltetrahydrofuran, and process for producing an intermediate thereof | KURARAY CO., LTD (JP) | 2001-05-29 | — | — | US | disclosed |
| EP-1057823-A2 | Process for producing 3-methyltetrahydrofuran, and process for producing an intermediate thereof | KURARAY CO., LTD. (JP) | 2000-12-06 | — | — | EP | disclosed |