⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14925919 | 0.83 | DRD4 (0.32) | — | |
| SCHEMBL14925923 | 0.83 | DRD4 (0.32) | — | |
| SCHEMBL10129414 | 0.83 | DRD4 (0.32) | — | |
| SCHEMBL14925920 | 0.83 | DRD4 (0.32) | — | |
| SCHEMBL2737431 | 0.82 | DRD4 (0.31) | — | |
| SCHEMBL2737418 | 0.82 | DRD4 (0.31) | — | |
| SCHEMBL2737408 | 0.82 | DRD4 (0.31) | — | |
| SCHEMBL2737379 | 0.82 | DRD4 (0.31) | — | |
| SCHEMBL2737417 | 0.82 | DRD4 (0.31) | — | |
| SCHEMBL22623061 | 0.76 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240238265-A1 | ADAMANTANE AMIDES AND THIOAMIDES FOR THE TREATMENT OF EBOLAVIRUS INFECTION | ARISAN THERAPEUTICS INC. (US) | 2024-07-18 | — | — | US | disclosed |
| WO-2021262426-A9 | ADAMANTANE AMIDES AND THIOAMIDES FOR THE TREATMENT OF EBOLAVIRUS INFECTION | ARISAN THERAPEUTICS INC. (US) | 2022-03-17 | — | — | WO | disclosed |