⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1835321 | 0.86 | — | — | |
| SCHEMBL9067632 | 0.83 | — | — | |
| SCHEMBL28138467 | 0.78 | — | — | |
| SCHEMBL1831048 | 0.75 | — | — | |
| SCHEMBL1834925 | 0.74 | GNAO1 (0.39) | — | |
| SCHEMBL3960927 | 0.73 | — | — | |
| SCHEMBL4625941 | 0.72 | — | — | |
| Bromide SCHEMBL28012666 | 0.71 | — | — | |
| SCHEMBL21078106 | 0.70 | GANAB (0.30) | — | |
| SCHEMBL21208235 | 0.70 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008064239-A2 | IMIDAZOLIDINE DERIVATIVE MASS TAGS | PERKINELMER LAS, INC. (US) | 2008-05-29 | — | — | WO | claimed |
| CN-104710472-A | Imidazolintrialkylphosphate compound, preparation method and ionic salt solution thereof, and preparation method of ionic salt solution | WUHAN HEADSPRING TECHNOLOGY DEV CO LTD | 2015-06-17 | — | — | CN | disclosed |
| WO-2008064239-A2 | IMIDAZOLIDINE DERIVATIVE MASS TAGS | PERKINELMER LAS, INC. (US) | 2008-05-29 | — | — | WO | disclosed |