⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22103348 | 0.90 | NPSR1 (0.32) | — | |
| SCHEMBL22103062 | 0.90 | — | — | |
| SCHEMBL22102767 | 0.88 | ALDH1A1 (0.31) | — | |
| SCHEMBL20044526 | 0.86 | PDE4A (0.31) | — | |
| SCHEMBL24119923 | 0.83 | KMT2A (0.31) | — | |
| SCHEMBL23333465 | 0.79 | — | — | |
| SCHEMBL22102770 | 0.78 | ALDH1A1 (0.31) | — | |
| SCHEMBL23334277 | 0.77 | — | — | |
| SCHEMBL23334279 | 0.77 | — | — | |
| SCHEMBL24120991 | 0.76 | — | — |
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-20200194684-A1 | PHOTOACTIVE COMPOUND | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 2020-06-18 | — | — | US | disclosed |