⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11124454 | 0.76 | — | — | |
| SCHEMBL4087560 | 0.76 | ALDH1A1 (0.37) | — | |
| SCHEMBL3360475 | 0.73 | — | — | |
| SCHEMBL16098518 | 0.73 | ZDHHC20 (0.39) | — | |
| SCHEMBL14242749 | 0.70 | ZDHHC20 (0.44) | — | |
| SCHEMBL12683538 | 0.67 | PAOX (0.36) | — | |
| SCHEMBL28785373 | 0.67 | — | — | |
| SCHEMBL5323569 | 0.67 | — | — | |
| SCHEMBL2801951 | 0.66 | — | — | |
| SCHEMBL25933346 | 0.65 | — | — |
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-6638143-B2 | Ion exchange materials for chemical mechanical polishing | APPLIED MATERIALS, INC. | 2003-10-28 | — | — | US | disclosed |
| US-20020077035-A1 | Ion exchange materials for chemical mechanical polishing | APPLIED MATERIALS, INC. | 2002-06-20 | — | — | US | disclosed |
| US-3924046-A | Dyes and pigmented articles wherein the fixing agent is a polymer based on N-formyl-N-acryloyl-methylenediamines | CASSELLA FARBWERKE MAINKUR AG | 1975-12-02 | — | — | US | disclosed |