⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1042270 | 0.89 | SIGMAR1 (0.30) | — | |
| SCHEMBL1042526 | 0.89 | — | — | |
| SCHEMBL2909290 | 0.84 | — | — | |
| SCHEMBL8862832 | 0.80 | ICMT (0.30) | — | |
| SCHEMBL4213712 | 0.77 | KDM4E (0.32) | — | |
| SCHEMBL4604835 | 0.77 | — | — | |
| SCHEMBL1344959 | 0.76 | — | — | |
| SCHEMBL4849975 | 0.76 | KDM4E (0.31) | — | |
| SCHEMBL9158932 | 0.76 | CYP1A2 (0.46) | — | |
| SCHEMBL9156561 | 0.76 | CYP1A2 (0.46) | — |
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-5153088-A | High sensitivity mixture also with charge transferring substituted phenyl diamines | MITA INDUSTRIAL CO., LTD. (JP) | 1992-10-06 | — | — | US | disclosed |