⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12437180 | 0.89 | CA12 (0.34) | — | |
| SCHEMBL13293940 | 0.89 | FDPS (0.31) | — | |
| SCHEMBL8949457 | 0.87 | MAPT (0.33) | — | |
| SCHEMBL22763803 | 0.87 | LCK (0.41) | — | |
| SCHEMBL13267614 | 0.87 | DNM1 (0.40) | — | |
| SCHEMBL13267718 | 0.87 | DNM1 (0.40) | — | |
| SCHEMBL678643 | 0.85 | SIGMAR1 (0.38) | — | |
| SCHEMBL25828209 | 0.83 | ALDH1A1 (0.30) | — | |
| SCHEMBL13616906 | 0.83 | PIK3CD (0.31) | — | |
| SCHEMBL13293939 | 0.81 | SIGMAR1 (0.32) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170312363-A1 | MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR | XIAMEN SINOPEG BIOTECH CO., LTD. (CN) | 2017-11-02 | — | — | US | disclosed |
| EP-2975019-A1 | RUTHENIUM CATALYZED HYDROAMINOMETHYLATION | Evonik Degussa GmbH (DE) | 2016-01-20 | — | — | EP | disclosed |
| US-20150191477-A1 | Fluoride Processing Method | GE HEALTHCARE LIMITED (GB) | 2015-07-09 | — | — | US | disclosed |
| US-8980221-B2 | Fluoride processing method | GE HEALTHCARE LIMITED (GB) | 2015-03-17 | — | — | US | disclosed |
| US-20100285570-A1 | FLUORIDE PROCESSING METHOD | JACKSON ALEXANDER | 2010-11-11 | — | — | US | disclosed |
| US-20100178242-A1 | LABELLING METHODS | GE HEALTHCARE LIMITED (GB) | 2010-07-15 | — | — | US | disclosed |