⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL144709 | 0.95 | — | — | |
| Fluoride Ion SCHEMBL190899 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL2439108 | 0.91 | — | — | |
| Water SCHEMBL190437 | 0.91 | — | — | |
| SCHEMBL10382653 | 0.82 | — | — | |
| Perchlorate SCHEMBL6561565 | 0.81 | — | — | |
| SCHEMBL10382187 | 0.76 | — | — | |
| SCHEMBL5142546 | 0.76 | — | — | |
| Formic Acid SCHEMBL3812921 | 0.75 | BBOX1 (0.30) | — | |
| SCHEMBL10385914 | 0.75 | BBOX1 (0.30) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1991001391-A1 | PRODUCTION OF METAL BOROHYDRIDES AND ORGANIC ONIUM BOROHYDRIDES | SOUTHWESTERN ANALYTICAL CHEMICALS, INC. (US) | 1991-02-07 | — | — | WO | disclosed |
| WO-1990015170-A1 | PRODUCTION OF QUATERNARY AMMONIUM AND QUATERNARY PHOSPHONIUM BOROHYDRIDES | SOUTHWESTERN ANALYTICAL CHEMICALS, INC. (US) | 1990-12-13 | — | — | WO | disclosed |
| US-4931154-A | Production of metal borohydrides and organic onium borohydrides | SOUTHWESTERN ANALYTICAL CHEMICALS, INC. (US) | 1990-06-05 | — | — | US | disclosed |
| US-4904357-A | Production of quaternary ammonium and quaternary phosphonium borohydrides | SOUTHWESTERN ANALYTICAL (US) | 1990-02-27 | — | — | US | disclosed |