⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3847687 | 0.85 | FNTA (0.36) | — | |
| SCHEMBL291060 | 0.85 | FNTA (0.36) | — | |
| Hydrogen Sulfide SCHEMBL8505278 | 0.83 | FNTA (0.35) | — | |
| SCHEMBL290897 | 0.77 | FNTA (0.37) | — | |
| SCHEMBL886924 | 0.77 | FNTA (0.37) | — | |
| SCHEMBL5086044 | 0.75 | FNTA (0.36) | — | |
| SCHEMBL5086033 | 0.75 | FNTA (0.36) | — | |
| SCHEMBL3847692 | 0.71 | FNTA (0.41) | — | |
| SCHEMBL7185104 | 0.71 | FNTA (0.41) | — | |
| SCHEMBL2175544 | 0.71 | ALOX15 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20200330985-A1 | A BIOSENSOR SYSTEM FOR USE IN POINT-OF-CARE APPLICATIONS AND A METHOD FOR FABRICATING SAME | TECHNOLOGICAL UNIVERSITY DUBLIN (IE) | 2020-10-22 | — | — | US | disclosed |