⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6564156 | 1.00 | — | — | |
| SCHEMBL15001233 | 1.00 | — | — | |
| SCHEMBL10509330 | 0.73 | — | — | |
| SCHEMBL17265351 | 0.71 | — | — | |
| SCHEMBL17862053 | 0.71 | — | — | |
| SCHEMBL14178235 | 0.71 | — | — | |
| SCHEMBL12746292 | 0.71 | — | — | |
| SCHEMBL12857875 | 0.71 | — | — | |
| SCHEMBL264558 | 0.69 | — | — | |
| SCHEMBL264343 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3638665-B1 | HERBICIDAL 3-PHENYLISOXAZOLINE-5-CARBOXAMIDES OF TETRAHYDRO AND DIHYDROFURAN CARBOXYLIC ACIDS AND ESTERS | BAYER AG (DE) | 2021-07-21 | — | — | EP | disclosed |
| US-7163986-B2 | Siloxane copolymer, making method, and thermosetting resin composition | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2007-01-16 | — | — | US | disclosed |