⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7053456 | 0.96 | — | — | |
| SCHEMBL50502 | 0.96 | — | — | |
| Water SCHEMBL27437140 | 0.93 | — | — | |
| SCHEMBL28020150 | 0.87 | — | — | |
| Ether SCHEMBL9354006 | 0.82 | — | — | |
| Acetic Acid SCHEMBL28395322 | 0.82 | — | — | |
| Ethylene Glycol SCHEMBL8666283 | 0.82 | — | — | |
| SCHEMBL9850567 | 0.76 | ALDH1A1 (0.30) | — | |
| Propane SCHEMBL10594073 | 0.71 | — | — | |
| SCHEMBL3397239 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-107313081-A | A kind of logical blind hole plates electroplate liquid and electro-plating method altogether | 苏州天承化工有限公司 | 2017-11-03 | — | — | CN | disclosed |
| CN-107217282-A | A kind of high TP values soft board electroplate liquid and electro-plating method | 苏州天承化工有限公司 | 2017-09-29 | — | — | CN | disclosed |