⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7648686 | 0.82 | CES2 (0.62) | — | |
| SCHEMBL28748884 | 0.78 | — | — | |
| SCHEMBL236021 | 0.78 | — | — | |
| SCHEMBL2992142 | 0.78 | CES2 (0.52) | — | |
| SCHEMBL7770939 | 0.78 | CES2 (0.52) | — | |
| SCHEMBL1183367 | 0.77 | CES2 (0.56) | — | |
| Hydrochloric Acid SCHEMBL27579964 | 0.77 | CES2 (0.56) | — | |
| Hydrochloric Acid SCHEMBL28278752 | 0.77 | CES2 (0.56) | — | |
| SCHEMBL2985742 | 0.76 | CES2 (0.50) | — | |
| SCHEMBL29025780 | 0.75 | CES2 (0.54) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023210623-A1 | HALOALKYL SULFONE ANILIDE COMPOUND AND HERBICIDE CONTAINING SAME | 株式会社エス・ディー・エス バイオテック | 2023-11-02 | — | — | WO | disclosed |
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |