⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12698338 | 0.82 | SLC1A3 (0.48) | — | |
| SCHEMBL10591110 | 0.82 | SLC1A3 (0.65) | — | |
| SCHEMBL1197330 | 0.82 | SLC1A3 (0.65) | — | |
| SCHEMBL606620 | 0.82 | SLC1A3 (0.65) | — | |
| SCHEMBL1196043 | 0.82 | SLC1A3 (0.65) | — | |
| SCHEMBL9346677 | 0.80 | TP53 (0.47) | — | |
| SCHEMBL466551 | 0.80 | — | — | |
| SCHEMBL15114574 | 0.80 | — | — | |
| SCHEMBL1085084 | 0.80 | — | — | |
| SCHEMBL10592338 | 0.78 | SLC1A3 (0.54) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1767993-B1 | Positive photosensitive composition and pattern forming method using the same | FUJIFILM CORP (JP) | 2008-12-24 | — | — | EP | claimed |
| WO-2019071187-A1 | STABILIZED STEVIOL GLYCOSIDE COMPOSITIONS AND USES THEREOF | CARGILL, INCORPORATED (US) | 2019-04-11 | — | — | WO | disclosed |
| WO-2017184871-A1 | CARBIDOPA AND L-DOPA PRODRUGS AND METHODS OF USE | ABBVIE INC. (US) | 2017-10-26 | — | — | WO | disclosed |
| US-20130172317-A1 | TRIAZINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION HAVING AN ANALGESIC ACTIVITY COMPRISING THE SAME | SHIONOGI & CO., LTD. (JP) | 2013-07-04 | — | — | US | disclosed |
| US-4595532-A | N-(substituted-methyl)-azetidin-2-ones | UNIVERSITY OF NOTRE DAME DU LAC (US) | 1986-06-17 | — | — | US | disclosed |