⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12448927 | 0.95 | — | — | |
| SCHEMBL14300174 | 0.86 | CHEK2 (0.31) | — | |
| SCHEMBL14300173 | 0.78 | — | — | |
| SCHEMBL12449776 | 0.75 | — | — | |
| SCHEMBL12449777 | 0.75 | CHEK2 (0.33) | — | |
| SCHEMBL12449264 | 0.71 | — | — | |
| SCHEMBL1863477 | 0.62 | ALDH1A1 (0.37) | — | |
| SCHEMBL4266561 | 0.60 | ME2 (0.34) | — | |
| SCHEMBL12971439 | 0.60 | APOBEC3A (0.32) | — | |
| Hydrochloric Acid SCHEMBL3287049 | 0.59 | APOBEC3A (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 |
|---|---|---|---|---|---|---|---|
| EP-1558616-B1 | MESO-SUBSTITUTED PORPHYRINS | MOLTENI & C (IT) | 2008-02-27 | — | — | EP | disclosed |