⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4546305 | 0.61 | — | — | |
| SCHEMBL6293015 | 0.58 | — | — | |
| SCHEMBL472562 | 0.58 | — | — | |
| SCHEMBL28138626 | 0.58 | — | — | |
| SCHEMBL333801 | 0.58 | — | — | |
| SCHEMBL28145186 | 0.58 | — | — | |
| SCHEMBL6747842 | 0.55 | — | — | |
| Hydrochloric Acid SCHEMBL30602532 | 0.55 | — | — | |
| SCHEMBL23628375 | 0.50 | — | — | |
| SCHEMBL10019298 | 0.50 | — | — |
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-10889599-B2 | 1,1-diborylalkyl-1-metal compounds, preparation method thereof, and their applications toward synthesis of 1,1-diboronate ester compounds | POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) | 2021-01-12 | — | — | US | disclosed |
| US-20190263837-A1 | 1,1-Diborylalkyl-1-Metal Compounds, Preparation Method Thereof, and Their Applications Toward Synthesis of 1,1-Diboronate Ester Compounds | POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) | 2019-08-29 | — | — | US | disclosed |