⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL228097 | 0.91 | — | — | |
| SCHEMBL227564 | 0.86 | HSPD1 (0.30) | — | |
| SCHEMBL9467444 | 0.82 | HSPD1 (0.30) | — | |
| SCHEMBL7932033 | 0.82 | HSPD1 (0.30) | — | |
| SCHEMBL939731 | 0.82 | HSPD1 (0.30) | — | |
| SCHEMBL7509065 | 0.78 | — | — | |
| SCHEMBL939829 | 0.77 | HSPD1 (0.32) | — | |
| SCHEMBL9465887 | 0.77 | HSPD1 (0.32) | — | |
| SCHEMBL10892143 | 0.77 | HSPD1 (0.32) | — | |
| SCHEMBL3788077 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4957953-A | MONO-AND POLYTETRAMETHYLPIPERIDINE ESTERS | ADEKA ARGUS CHEMICAL CO., LTD. (JP) | 1990-09-18 | — | — | US | claimed |
| US-4957953-A | MONO-AND POLYTETRAMETHYLPIPERIDINE ESTERS | ADEKA ARGUS CHEMICAL CO., LTD. (JP) | 1990-09-18 | — | — | US | disclosed |