⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1400956 | 1.00 | — | — | |
| SCHEMBL8330112 | 0.77 | — | — | |
| SCHEMBL29625445 | 0.75 | — | — | |
| SCHEMBL3548537 | 0.75 | — | — | |
| SCHEMBL27534111 | 0.75 | — | — | |
| SCHEMBL30887305 | 0.75 | — | — | |
| SCHEMBL27829686 | 0.75 | — | — | |
| SCHEMBL27880589 | 0.75 | — | — | |
| SCHEMBL11326011 | 0.73 | — | — | |
| SCHEMBL29542997 | 0.73 | — | — |
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-20130172457-A1 | Phosphorus-Containing Mixtures, Processes for Preparing Them and Use Thereof | CLARIANT FINANCE (BVI) LIMITED (VG) | 2013-07-04 | — | — | US | disclosed |