⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7671059 | 0.69 | — | — | |
| SCHEMBL1961637 | 0.69 | — | — | |
| SCHEMBL9618584 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL6279566 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL5098999 | 0.65 | — | — | |
| SCHEMBL7677175 | 0.65 | — | — | |
| SCHEMBL3128723 | 0.63 | — | — | |
| SCHEMBL2305857 | 0.62 | — | — | |
| SCHEMBL17258227 | 0.62 | ALDH1A1 (0.33) | — | |
| SCHEMBL7297658 | 0.62 | ALDH1A1 (0.52) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11339320-B2 | Thiol-formyl hemiacetal corrosion inhibitors | CHAMPIONX USA INC. (US) | 2022-05-24 | — | — | US | disclosed |
| EP-3548582-A1 | THIOL-FORMYL HEMIACETAL CORROSION INHIBITORS | Ecolab USA Inc. (US) | 2019-10-09 | — | — | EP | disclosed |
| US-20180346795-A9 | THIOL-FORMYL HEMIACETAL CORROSION INHIBITORS | APERGY BMCS ACQUISITION CORP | 2018-12-06 | — | — | US | disclosed |
| WO-2018102724-A1 | THIOL-FORMYL HEMIACETAL CORROSION INHIBITORS | ECOLAB USA INC. (US) | 2018-06-07 | — | — | WO | disclosed |
| US-20180155609-A1 | THIOL-FORMYL HEMIACETAL CORROSION INHIBITORS | ECOLAB USA INC. | 2018-06-07 | — | — | US | disclosed |