⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL56255 | 1.00 | — | — | |
| SCHEMBL82969 | 0.82 | — | — | |
| SCHEMBL17607587 | 0.82 | TSHR (0.35) | — | |
| SCHEMBL1484068 | 0.82 | TSHR (0.35) | — | |
| SCHEMBL4654375 | 0.82 | TSHR (0.35) | — | |
| SCHEMBL3246553 | 0.79 | TSHR (0.33) | — | |
| SCHEMBL28431395 | 0.77 | TSHR (0.32) | — | |
| SCHEMBL9215179 | 0.75 | — | — | |
| SCHEMBL3339089 | 0.75 | TSHR (0.41) | — | |
| SCHEMBL5984673 | 0.75 | — | — |
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-4025300-A1 | ATP-REGULATED POTASSIUM CHANNEL OPENERS COMPRISING GUANIDINE AND USES THEREOF | Salzman Group Ltd. (IL) | 2022-07-13 | — | — | EP | disclosed |
| WO-2021044413-A1 | ATP-REGULATED POTASSIUM CHANNEL OPENERS COMPRISING GUANIDINE AND USES THEREOF | SALZMAN GROUP LTD. (IL) | 2021-03-11 | — | — | WO | disclosed |
| US-H645-H | Process for the conversion of maleic acid derivatives to their corresponding fumaric isomers | THE NUTRASWEET COMPANY (US) | 1989-06-06 | — | — | US | disclosed |