⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20475501 | 0.72 | — | — | |
| SCHEMBL545888 | 0.70 | — | — | |
| SCHEMBL29130774 | 0.69 | — | — | |
| SCHEMBL16588383 | 0.69 | — | — | |
| SCHEMBL10529335 | 0.68 | — | — | |
| Ethylene SCHEMBL1115912 | 0.62 | TSHR (0.33) | — | |
| Ethylene SCHEMBL1065214 | 0.62 | TSHR (0.33) | — | |
| SCHEMBL1101253 | 0.60 | ALDH1A1 (0.44) | — | |
| SCHEMBL5666084 | 0.60 | — | — | |
| Ethylene SCHEMBL6267949 | 0.60 | TSHR (0.37) | — |
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-3850068-A1 | PHASE STABLE AND LOW FOAMING AQUEOUS DETERGENT COMPOSITIONS HAVING A LONG TIME ENZYME ACTIVITY | Ecolab USA Inc. (US) | 2021-07-21 | — | — | EP | claimed |
| WO-2020052743-A1 | PHASE STABLE AND LOW FOAMING AQUEOUS DETERGENT COMPOSITIONS HAVING A LONG TIME ENZYME ACTIVITY | ECOLAB USA INC. (US) | 2020-03-19 | — | — | WO | claimed |