⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6553 | 0.89 | — | — | |
| SCHEMBL22462421 | 0.80 | — | — | |
| SCHEMBL1628467 | 0.55 | — | — | |
| SCHEMBL6937048 | 0.45 | — | — | |
| SCHEMBL50 | 0.45 | — | — | |
| SCHEMBL10698912 | 0.45 | — | — | |
| SCHEMBL9144971 | 0.45 | — | — | |
| SCHEMBL713458 | 0.45 | — | — | |
| Potassium Iodide SCHEMBL22616409 | 0.45 | — | — | |
| Charcoal, Activated SCHEMBL8562816 | 0.45 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110678468-B | 5, 6-fused bicyclic compounds and compositions thereof for the treatment of parasitic diseases | 诺华股份有限公司 | 2022-07-29 | — | — | CN | disclosed |
| CN-110678468-A | 5, 6-fused bicyclic compounds and compositions thereof for the treatment of parasitic diseases | 诺华股份有限公司 | 2020-01-10 | — | — | CN | disclosed |
| WO-2018231782-A2 | METAL COMPLEXES AS PHARMACEUTICALS FOR TREATMENT AND PREVENTION OF CANCER AND INFLAMMATORY DISEASES | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2018-12-20 | — | — | WO | disclosed |
| US-20180353539-A1 | METAL COMPLEXES AS PHARMACEUTICALS FOR TREATMENT AND PREVENTION OF CANCER AND INFLAMMATORY DISEASES | UNIV SOUTHERN CALIFORNIA (US) | 2018-12-13 | — | — | US | disclosed |