⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL78730 | 0.76 | — | — | |
| SCHEMBL2787212 | 0.75 | — | — | |
| SCHEMBL2787411 | 0.72 | — | — | |
| SCHEMBL2791758 | 0.72 | — | — | |
| SCHEMBL8906766 | 0.69 | — | — | |
| SCHEMBL6505253 | 0.68 | — | — | |
| SCHEMBL27590677 | 0.67 | — | — | |
| SCHEMBL2787418 | 0.66 | RXRA (0.32) | — | |
| SCHEMBL8184066 | 0.66 | NPC1 (0.31) | — | |
| SCHEMBL5064183 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1980600-B | Synthesis of porphyrins designed for attachment to electroactive surfaces via one or more carbon tethers | UNIV NORTH CAROLINA | 2011-08-10 | — | — | CN | disclosed |
| CN-1980600-A | Synthesis of porphyrins designed for attachment to electroactive surfaces via one or more carbon tethers | UNIV NORTH CAROLINA (US) | 2007-06-13 | — | — | CN | disclosed |