⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6505335 | 0.78 | — | — | |
| SCHEMBL11323386 | 0.77 | ECE1 (0.37) | — | |
| SCHEMBL5246199 | 0.76 | ALOX15 (0.44) | — | |
| SCHEMBL9662063 | 0.75 | — | — | |
| SCHEMBL4792858 | 0.75 | — | — | |
| SCHEMBL10296109 | 0.74 | TSHR (0.40) | — | |
| SCHEMBL7034111 | 0.74 | ECE1 (0.42) | — | |
| SCHEMBL10296120 | 0.74 | MCL1 (0.33) | — | |
| SCHEMBL3856802 | 0.74 | ECE1 (0.42) | — | |
| SCHEMBL16869494 | 0.73 | ECE1 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0796646-B1 | Method for the removal of carbon dioxide present in gases and absorbent | KANSAI ELECTRIC POWER CO (JP) | 2003-11-12 | — | — | EP | disclosed |
| US-5904908-A | USING AN AQUEOUS SOLUTION CONTAINING AN ALKYLAMINOAMIDE COMPOUND | MITSUBISHI HEAVY INDUSTRIES, LTD. (JP) | 1999-05-18 | — | — | US | disclosed |
| EP-0796646-A1 | Method for the removal of carbon dioxide present in gases and absorbent | THE KANSAI ELECTRIC POWER CO., INC. (JP) | 1997-09-24 | — | — | EP | disclosed |