⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8771611 | 0.81 | — | — | |
| SCHEMBL5853824 | 0.70 | ALDH1A1 (0.32) | — | |
| SCHEMBL350685 | 0.67 | — | — | |
| SCHEMBL11680155 | 0.67 | — | — | |
| SCHEMBL717496 | 0.66 | ALDH1A1 (0.36) | — | |
| SCHEMBL28218723 | 0.65 | — | — | |
| SCHEMBL27831045 | 0.65 | LMNA (0.32) | — | |
| SCHEMBL20101 | 0.65 | — | — | |
| SCHEMBL1418648 | 0.64 | — | — | |
| SCHEMBL13884116 | 0.64 | — | — |
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-0974595-B1 | PROCESS FOR PRODUCING BORON COMPOUNDS | SHOWA DENKO KK (JP) | 2003-10-01 | — | — | EP | disclosed |
| US-6140537-A | REACTING AN ORGANIC OXYBORON COMPOUND WITH LITHIUM, MAGNESIUM, OR COMPOUND THEREOF; FORMING BORON ANION COMPOUND; ION EXCHANGING | SHOWA DENKO K.K. (JP) | 2000-10-31 | — | — | US | disclosed |
| EP-0974595-A1 | PROCESS FOR PRODUCING BORON COMPOUNDS | Showa Denko Kabushiki Kaisha (JP) | 2000-01-26 | — | — | EP | disclosed |