⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4903675 | 0.63 | — | — | |
| SCHEMBL6244223 | 0.62 | LMNA (0.39) | — | |
| Allyl Alcohol SCHEMBL28750769 | 0.59 | — | — | |
| SCHEMBL5944143 | 0.59 | SLC40A1 (0.33) | — | |
| SCHEMBL4442903 | 0.57 | CA2 (0.40) | — | |
| SCHEMBL14769888 | 0.57 | PSIP1 (0.50) | — | |
| SCHEMBL15234282 | 0.56 | — | — | |
| SCHEMBL6601693 | 0.56 | — | — | |
| SCHEMBL21580525 | 0.55 | — | — | |
| SCHEMBL1260239 | 0.55 | — | — |
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-1519928-B1 | METHOD FOR PRODUCING HETEROCYCLIC FLUOROALKENYL SULFONES | MAKHTESHIM CHEM WORKS LTD (IL) | 2014-04-30 | — | — | EP | disclosed |
| EP-2258693-A1 | Process for the preparation of heterocyclic fluoralkenylulfones | Makhteshim Chemical Works Ltd. (IL) | 2010-12-08 | — | — | EP | disclosed |