⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23731 | 0.74 | — | — | |
| Ammonia Solution, Strong SCHEMBL27516621 | 0.72 | — | — | |
| SCHEMBL7697357 | 0.70 | — | — | |
| SCHEMBL8030518 | 0.70 | — | — | |
| SCHEMBL3578552 | 0.70 | — | — | |
| SCHEMBL444005 | 0.70 | — | — | |
| SCHEMBL16556682 | 0.70 | — | — | |
| SCHEMBL493044 | 0.70 | — | — | |
| SCHEMBL22166575 | 0.70 | — | — | |
| SCHEMBL19370773 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024018354-A1 | A PROCESS FOR THE SYNTHESIS OF 4-ALKOXY-3-HYDROXYPICOLINIC ACIDS AND INTERMEDIATES THEREOF | PI INDUSTRIES LTD. (IN) | 2024-01-25 | — | — | WO | disclosed |
| CN-105408322-B | Terazololine-one compound and application thereof | 住友化学株式会社 | 2019-04-19 | — | — | CN | disclosed |
| EP-1716088-A1 | CATALYTIC ASYMMETRIC SYNTHESIS OF OPTICALLY ACTIVE ALPHA-HALO-CAR BONYL COMPOUNDS | Cheminova A/S (DK) | 2006-11-02 | — | — | EP | disclosed |
| WO-2005080298-A1 | CATALYTIC ASYMMETRIC SYNTHESIS OF OPTICALLY ACTIVE α-HALO-CARBONYL COMPOUNDS | CHEMINOVA A/S (DK) | 2005-09-01 | — | — | WO | disclosed |
| EP-0060120-B1 | PROCESS FOR PREPARING 4-HALOAZETIDIN-2-ONES | ELI LILLY AND COMPANY (US) | 1984-12-19 | — | — | EP | disclosed |
| EP-0003258-A1 | Preparation of N-chloroimides and a novel N-chloroimide | ELI LILLY AND COMPANY (US) | 1979-08-08 | — | — | EP | disclosed |