⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22105 | 0.89 | — | — | |
| Methylene Chloride SCHEMBL9389820 | 0.86 | TSHR (0.33) | — | |
| Hypochlorous Acid SCHEMBL11208004 | 0.86 | — | — | |
| SCHEMBL7851077 | 0.85 | — | — | |
| Water SCHEMBL1155773 | 0.85 | — | — | |
| Methane SCHEMBL23927285 | 0.85 | — | — | |
| SCHEMBL3312437 | 0.85 | — | — | |
| SCHEMBL16738682 | 0.85 | — | — | |
| Ammonia Solution, Strong SCHEMBL797498 | 0.85 | — | — | |
| Bromide SCHEMBL6752530 | 0.85 | — | — |
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-5320774-A | Preparation of organometallic amide compositions | FMC CORPORATION (US) | 1994-06-14 | — | — | US | disclosed |
| US-5002689-A | Heat stable, soluble stabilizers | LITHIUM CORPORATION OF AMERICA (US) | 1991-03-26 | — | — | US | disclosed |