⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4354076 | 1.00 | — | — | |
| Formamide SCHEMBL28192627 | 0.77 | — | — | |
| SCHEMBL6562703 | 0.74 | — | — | |
| SCHEMBL6522063 | 0.74 | — | — | |
| Water SCHEMBL21518539 | 0.74 | — | — | |
| SCHEMBL122 | 0.74 | — | — | |
| Water SCHEMBL31152866 | 0.74 | — | — | |
| SCHEMBL120 | 0.74 | — | — | |
| SCHEMBL5199999 | 0.74 | — | — | |
| Dimethylformamide SCHEMBL5938353 | 0.73 | TSHR (0.43) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090036608-A1 | CHLOROPRENE-BASED BLOCK COPOLYMER, SOAPLESS POLYCHLOROPRENE-BASED LATEX, AND PROCESSES FOR PRODUCING THE SAME | TOSOH CORPORATION (JP) | 2009-02-05 | — | — | US | disclosed |