⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL325076 | 0.77 | ALDH1A1 (0.62) | — | |
| SCHEMBL9819151 | 0.77 | ALDH1A1 (0.62) | — | |
| SCHEMBL290485 | 0.74 | — | — | |
| SCHEMBL36968 | 0.74 | — | — | |
| SCHEMBL8519755 | 0.74 | — | — | |
| Iodide SCHEMBL8715119 | 0.74 | ALDH1A1 (0.59) | — | |
| SCHEMBL11855121 | 0.74 | — | — | |
| SCHEMBL20174140 | 0.74 | — | — | |
| SCHEMBL1733093 | 0.74 | — | — | |
| SCHEMBL28461429 | 0.74 | — | — |
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-2021076993-A1 | COMPOSITIONS AND METHODS FOR MODIFYING EUKARYOTIC CELLS | ORCHARD THERAPEUTICS (EUROPE) LIMITED (GB) | 2021-04-22 | — | — | WO | disclosed |
| EP-3491922-A1 | PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO | Dow AgroSciences LLC (US) | 2019-06-05 | — | — | EP | disclosed |
| US-10253256-B2 | Use of sulfur and selenium compounds as precursors to nanostructured materials | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2019-04-09 | — | — | US | disclosed |
| EP-2934135-B1 | PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2018-01-31 | — | — | EP | disclosed |
| US-9175026-B2 | Synthesis of thioether containing trialkoxysilanes | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2015-11-03 | — | — | US | disclosed |
| EP-0272909-A2 | Synthesis of aminothioacetamides | ELI LILLY AND COMPANY (US) | 1988-06-29 | — | — | EP | disclosed |