⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6677099 | 0.88 | — | — | |
| SCHEMBL9369240 | 0.77 | — | — | |
| SCHEMBL8348026 | 0.72 | — | — | |
| SCHEMBL6415640 | 0.72 | — | — | |
| SCHEMBL6677733 | 0.71 | — | — | |
| SCHEMBL23748774 | 0.71 | TSHR (0.30) | — | |
| SCHEMBL11986744 | 0.71 | TSHR (0.30) | — | |
| SCHEMBL1218125 | 0.71 | — | — | |
| SCHEMBL17992266 | 0.71 | TSHR (0.30) | — | |
| SCHEMBL9292079 | 0.69 | TSHR (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5275669-A | Degreasing glass, metal, plastic and fiber surfaces | ALLIEDSIGNAL INC. (US) | 1994-01-04 | — | — | US | claimed |
| EP-1193309-B1 | Solvent blend for use in high purity precursor removal | AIR PROD & CHEM (US) | 2004-11-03 | — | — | EP | disclosed |
| EP-1193309-A1 | Solvent blend for use in high purity precursor removal | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2002-04-03 | — | — | EP | disclosed |