⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11389769 | 0.74 | — | — | |
| SCHEMBL8307702 | 0.73 | — | — | |
| SCHEMBL22361183 | 0.64 | — | — | |
| SCHEMBL16634400 | 0.64 | — | — | |
| SCHEMBL343294 | 0.64 | — | — | |
| SCHEMBL7288781 | 0.63 | — | — | |
| SCHEMBL10343777 | 0.61 | — | — | |
| SCHEMBL19057052 | 0.58 | — | — | |
| SCHEMBL13318151 | 0.58 | — | — | |
| SCHEMBL21218307 | 0.58 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240251788-A1 | HERBICIDE/SAFENER COMBINATION BASED ON SAFENERS FROM THE CLASS OF SUBSTITUTED [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACIDS AND THEIR SALTS | BAYER AKTIENGESELLSCHAFT (DE) | 2024-08-01 | — | — | US | claimed |
| US-20240251788-A1 | HERBICIDE/SAFENER COMBINATION BASED ON SAFENERS FROM THE CLASS OF SUBSTITUTED [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACIDS AND THEIR SALTS | BAYER AKTIENGESELLSCHAFT (DE) | 2024-08-01 | — | — | US | disclosed |
| CN-113666882-B | Water phase preparation method of isoxazoline compound with participation of vitamin E micro-micelle | 浙江工业大学 | 2023-05-23 | — | — | CN | disclosed |
| CN-113666882-A | Aqueous phase preparation method of isoxazoline compound participated by vitamin E micelle | 浙江工业大学 | 2021-11-19 | — | — | CN | disclosed |
| WO-2020115506-A1 | QUINOLINONE AND BENZOXAZINE DERIVATIVES AS MUSCARINIC M1 AND/OR M4 RECEPTOR AGONISTS | HEPTARES THERAPEUTICS LIMITED (GB) | 2020-06-11 | — | — | WO | disclosed |
| US-5739396-A | CHIRAL COMPOUND COMPRISING CHIRAL BACKBONE TO WHICH IS BOUND TWO OR THREE METAL BINDING MOIETIES | STANFORD UNIVERSITY (US) | 1998-04-14 | — | — | US | disclosed |
| WO-1993012260-A2 | ASYMMETRIC LIGANDS USEFUL FOR TRANSITION METAL CATALYZED BOND FORMING REACTIONS | BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIO (US) | 1993-06-24 | — | — | WO | disclosed |