⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10354150 | 0.98 | PNP (0.37) | — | |
| SCHEMBL7891944 | 0.81 | — | — | |
| SCHEMBL309011 | 0.76 | — | — | |
| SCHEMBL10402367 | 0.73 | — | — | |
| SCHEMBL10402369 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL9534244 | 0.71 | TSHR (0.50) | — | |
| SCHEMBL19226336 | 0.70 | MAT2A (0.44) | — | |
| SCHEMBL1057956 | 0.68 | — | — | |
| Water SCHEMBL9836997 | 0.67 | CYP3A4 (0.59) | — | |
| SCHEMBL15903944 | 0.65 | MAT2A (0.34) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0177016-B1 | PYRIDYLOXY DERIVATIVES | Ikeda Mohando Co., Ltd. (JP) | 1993-06-23 | — | — | EP | disclosed |
| EP-0163324-B1 | AMINOALKYLPHENOXY DERIVATIVES | Ikeda Mohando Co., Ltd. (JP) | 1990-09-12 | — | — | EP | disclosed |
| US-4710498-A | ANTIULCER AGENTS | IKEDA MOHANDO CO., LTD. (JP) | 1987-12-01 | — | — | US | disclosed |
| US-4673747-A | HISTAMINE ANTAGONIST, ANTIULCER AGENTS | IKEDA MOHANDO CO., LTD. (JP) | 1987-06-16 | — | — | US | disclosed |
| US-4639523-A | ANTIULCER | IKEDA MOHANDO CO., LTD. (JP) | 1987-01-27 | — | — | US | disclosed |
| EP-0177016-A2 | Pyridyloxy derivatives | Ikeda Mohando Co., Ltd. (JP) | 1986-04-09 | — | — | EP | disclosed |
| EP-0163324-A2 | Aminoalkylphenoxy derivatives | Ikeda Mohando Co., Ltd. (JP) | 1985-12-04 | — | — | EP | disclosed |