⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15160619 | 1.00 | — | — | |
| SCHEMBL13018309 | 0.80 | — | — | |
| SCHEMBL13242309 | 0.77 | — | — | |
| SCHEMBL12670153 | 0.77 | — | — | |
| SCHEMBL21162907 | 0.74 | — | — | |
| SCHEMBL12729967 | 0.74 | — | — | |
| SCHEMBL8000603 | 0.71 | — | — | |
| SCHEMBL14886270 | 0.71 | — | — | |
| Valine SCHEMBL28760105 | 0.71 | SLC7A5 (0.88) | — | |
| Valine SCHEMBL20981544 | 0.71 | SLC7A5 (0.88) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023008895-A1 | ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | (주)피엔에이치테크 | 2023-02-02 | — | — | WO | disclosed |
| US-20220356303-A1 | LIPIDATED POLY(AMINO ACID) NANOSTRUCTURES | THE CURATORS OF THE UNIVERSITY OF MISSOURI | 2022-11-10 | — | — | US | disclosed |
| WO-2009111442-A1 | AMINO-QUINOXALINE AND AMINO-QUINOLINE COMPOUNDS FOR USE AS ADENOSINE A2a RECEPTOR ANTAGONISTS | SCHERING CORPORATION (US) | 2009-09-11 | — | — | WO | disclosed |
| WO-2006050991-A1 | COMPOUNDS HAVING ACTIVITY AT NK3 RECEPTOR AND USES THEREOF IN MEDICINE | SMITHKLINE BEECHAM CORPORATION (US) | 2006-05-18 | — | — | WO | disclosed |