⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21301 | 0.82 | — | — | |
| SCHEMBL9419844 | 0.82 | TRPA1 (0.33) | — | |
| SCHEMBL11202100 | 0.82 | — | — | |
| SCHEMBL14157891 | 0.82 | — | — | |
| SCHEMBL5466451 | 0.79 | — | — | |
| Ammonia Solution, Strong SCHEMBL15969117 | 0.79 | — | — | |
| Ethylene SCHEMBL17838321 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL10839055 | 0.79 | — | — | |
| SCHEMBL8863961 | 0.79 | — | — | |
| Charcoal, Activated SCHEMBL30400894 | 0.79 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113728136-B | Freshening compositions containing alkoxylated phenols | 宝洁公司 | 2024-03-29 | — | — | CN | disclosed |
| EP-3313908-B1 | INTERPENETRATING NETWORK MATERIAL | KEMIRA OYJ (FI) | 2021-08-11 | — | — | EP | disclosed |
| CN-110100051-A | Equipment for deconstructing textile waste | 皮塞尔控股有限公司 | 2019-08-06 | — | — | CN | disclosed |
| CN-101370863-A | Porous materials and process for their production | BASF SE (DE) | 2009-02-18 | — | — | CN | disclosed |