⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4267041 | 0.85 | ALDH1A1 (0.46) | — | |
| SCHEMBL27277948 | 0.82 | ALDH1A1 (0.44) | — | |
| SCHEMBL8716523 | 0.81 | — | — | |
| SCHEMBL1710128 | 0.78 | — | — | |
| SCHEMBL8050231 | 0.78 | — | — | |
| SCHEMBL4702066 | 0.78 | — | — | |
| SCHEMBL8744769 | 0.76 | — | — | |
| SCHEMBL9079670 | 0.76 | — | — | |
| SCHEMBL3044755 | 0.76 | — | — | |
| SCHEMBL338767 | 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-5529894-A | PYRAZOLOAZOLE BASED MAGENTA COUPLER, TIMING COUPLER; SHARPNESS, DESILVERING PROPERTIES | FUJI PHOTO FILM CO., LTD. (JP) | 1996-06-25 | — | — | US | disclosed |