⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9841402 | 1.00 | — | — | |
| SCHEMBL1153473 | 1.00 | — | — | |
| SCHEMBL7725 | 0.84 | — | — | |
| SCHEMBL2556849 | 0.84 | — | — | |
| SCHEMBL868495 | 0.80 | — | — | |
| SCHEMBL1705190 | 0.80 | — | — | |
| SCHEMBL5728116 | 0.77 | — | — | |
| Ethane SCHEMBL10716879 | 0.77 | — | — | |
| SCHEMBL5438089 | 0.77 | — | — | |
| SCHEMBL17222435 | 0.77 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1352977-A2 | Novel Desulfitobacterium strain for the degradation of chloroalkenes | UNIVERSITEIT GENT (BE) | 2003-10-15 | — | — | EP | claimed |
| WO-2016115455-A2 | 6-ARYL-7-SUBSTITUTED-3-(1H-PYRAZOL-5-YL)-7H-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZINES AS INHIBITORS OF THE STAT3 PATHWAY WITH ANTI-PROLIFERATIVE ACTIVITY | UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2016-07-21 | — | — | WO | disclosed |
| EP-1352977-A2 | Novel Desulfitobacterium strain for the degradation of chloroalkenes | UNIVERSITEIT GENT (BE) | 2003-10-15 | — | — | EP | disclosed |