⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16257904 | 0.59 | — | — | |
| SCHEMBL14515628 | 0.59 | — | — | |
| SCHEMBL14327630 | 0.58 | — | — | |
| SCHEMBL4386852 | 0.56 | — | — | |
| SCHEMBL169919 | 0.54 | — | — | |
| SCHEMBL3157149 | 0.54 | — | — | |
| Methane SCHEMBL23217135 | 0.53 | — | — | |
| Bromide SCHEMBL2450068 | 0.53 | — | — | |
| SCHEMBL185 | 0.50 | — | — | |
| SCHEMBL4685684 | 0.50 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2009006-A1 | UREIDE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES | TORAY INDUSTRIES, INC. (JP) | 2008-12-31 | — | — | EP | disclosed |