⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10705515 | 0.91 | — | — | |
| SCHEMBL8446336 | 0.80 | — | — | |
| SCHEMBL1164326 | 0.79 | APLNR (0.32) | — | |
| SCHEMBL2263006 | 0.79 | APLNR (0.32) | — | |
| SCHEMBL18110382 | 0.76 | FAAH (0.35) | — | |
| SCHEMBL5880394 | 0.76 | FAAH (0.35) | — | |
| SCHEMBL4107225 | 0.76 | FAAH (0.35) | — | |
| SCHEMBL5903659 | 0.76 | FAAH (0.35) | — | |
| SCHEMBL1931721 | 0.71 | APLNR (0.35) | — | |
| SCHEMBL68201 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20110082163-A1 | NOVEL URACIL COMPOUND OR SALT THEREOF HAVING HUMAN DEOXYURIDINE TRIPHOSPHATASE INHIBITORY ACTIVITY | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 2011-04-07 | — | — | US | disclosed |
| WO-2009147843-A1 | NOVEL URACIL COMPOUND HAVING INHIBITORY ACTIVITY ON HUMAN DEOXYURIDINE TRIPHOSPHATASE OR SALT THEREOF | 大鵬薬品工業株式会社 (JP) | 2009-12-10 | — | — | WO | disclosed |