⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8021090 | 0.80 | — | — | |
| SCHEMBL11647709 | 0.79 | — | — | |
| SCHEMBL225385 | 0.70 | APLNR (0.34) | — | |
| SCHEMBL13995866 | 0.69 | — | — | |
| SCHEMBL13995939 | 0.69 | — | — | |
| SCHEMBL13995808 | 0.66 | HTT (0.32) | — | |
| SCHEMBL13995957 | 0.65 | MMP2 (0.38) | — | |
| SCHEMBL13995956 | 0.65 | MMP2 (0.38) | — | |
| SCHEMBL18230680 | 0.65 | — | — | |
| SCHEMBL9158794 | 0.64 | APLNR (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-11322883-A | — | — | None | — | — | JP | disclosed |
| JP-H11322883-A | POLYADDITION COMPOUND CONTAINING UREA GROUP AND URETHODIONE GROUP, ITS PRODUCTION AND TRANSPARENT AND COLORED POLYURETHANE POWDER COATING MATERIAL CONTAINING THE SAME | DEGUSSA HUELS AG | 1999-11-26 | — | — | JP | disclosed |