⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8300608 | 0.80 | — | — | |
| SCHEMBL13960186 | 0.78 | — | — | |
| SCHEMBL43375 | 0.76 | — | — | |
| SCHEMBL14190927 | 0.76 | — | — | |
| SCHEMBL28934067 | 0.74 | TSHR (0.50) | — | |
| Hydrochloric Acid SCHEMBL9195017 | 0.72 | — | — | |
| SCHEMBL299420 | 0.72 | — | — | |
| SCHEMBL11414863 | 0.72 | — | — | |
| SCHEMBL132364 | 0.69 | TSHR (0.67) | — | |
| SCHEMBL180666 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010002115-A2 | FXA INHIBITORS WITH CYCLIC AMIDOXIME OR CYCLIC AMIDRAZONE AS P4 SUBUNIT, PROCESSES FOR THEIR PREPARATIONS, AND PHARMACEUTICAL COMPOSITIONS AND DERIVATIVES THEREOF | LEGOCHEM BIOSCIENCE LTD. (KR) | 2010-01-07 | — | — | WO | disclosed |
| WO-2008076256-A1 | WATER-SOLUBLE PRODRUGS OF CHLORAMPHENICOL, THIAMPHENICOL, AND ANALOGS THEREOF | SCHERING-PLOUGH LTD. (CH) | 2008-06-26 | — | — | WO | disclosed |