⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7256784 | 0.90 | CCR1 (0.32) | — | |
| SCHEMBL7262331 | 0.78 | — | — | |
| SCHEMBL7261397 | 0.71 | MIF (0.37) | — | |
| SCHEMBL7256756 | 0.71 | GRIN1 (0.30) | — | |
| SCHEMBL8906766 | 0.69 | — | — | |
| SCHEMBL8689824 | 0.68 | NPC1 (0.31) | — | |
| SCHEMBL1343311 | 0.66 | P2RY6 (0.30) | — | |
| SCHEMBL5050049 | 0.66 | — | — | |
| SCHEMBL12076189 | 0.66 | — | — | |
| SCHEMBL7258058 | 0.65 | P2RY6 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003055887-A1 | CONJUGATED PORPHYRIN, CHLORIN OR BACTERIOCHLORIN CHROMOPHORE | WELLCOME TRUST LIMITED (GB) | 2003-07-10 | — | — | WO | disclosed |
| EP-1294726-A2 | IMPROVEMENTS IN AND RELATING TO CHROMOPHORES | Catalyst Biomedica Ltd (GB) | 2003-03-26 | — | — | EP | disclosed |
| WO-2002000662-A1 | IMPROVEMENTS IN AND RELATING TO CHROMOPHORES | CATALYST BIOMEDICA LIMITED (GB) | 2002-01-03 | — | — | WO | disclosed |