⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2285647 | 0.72 | — | — | |
| SCHEMBL11499849 | 0.72 | — | — | |
| SCHEMBL28498214 | 0.70 | — | — | |
| SCHEMBL6524377 | 0.65 | EPHX1 (0.42) | — | |
| SCHEMBL461903 | 0.65 | — | — | |
| SCHEMBL3095899 | 0.65 | — | — | |
| SCHEMBL15765723 | 0.65 | — | — | |
| SCHEMBL21588733 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL1177847 | 0.63 | — | — | |
| SCHEMBL17898600 | 0.62 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4959309-A | Fast photochemical method of labelling nucleic acids for detection purposes in hybridization assays | MOLECULAR DIAGNOSTICS, INC. (US) | 1990-09-25 | — | — | US | disclosed |
| US-4737454-A | Fast photochemical method of labelling nucleic acids for detection purposes in hybridization assays | MOLECULAR DIAGNOSTICS, INC. (US) | 1988-04-12 | — | — | US | disclosed |
| EP-0131830-B1 | LABELLED NUCLEIC ACID PROBES AND ADDUCTS FOR THEIR PREPARATION | MOLECULAR DIAGNOSTICS, INC. (US) | 1986-12-10 | — | — | EP | disclosed |
| EP-0131830-A1 | Labelled nucleic acid probes and adducts for their preparation | MOLECULAR DIAGNOSTICS, INC. (US) | 1985-01-23 | — | — | EP | disclosed |