⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5611671 | 0.93 | — | — | |
| SCHEMBL7095177 | 0.91 | — | — | |
| SCHEMBL21750925 | 0.91 | — | — | |
| Lithium Ion SCHEMBL20604031 | 0.91 | — | — | |
| Bromide SCHEMBL21750993 | 0.89 | — | — | |
| SCHEMBL21751036 | 0.77 | — | — | |
| Tetramethylammonium Ion SCHEMBL1131208 | 0.76 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL395641 | 0.74 | — | — | |
| SCHEMBL21751004 | 0.71 | KMT2A (0.62) | — | |
| SCHEMBL21750995 | 0.70 | KMT2A (0.47) | — |
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-0985672-B1 | Method for purifying tetrakis(fluoroaryl)borate compounds | NIPPON CATALYTIC CHEM IND (JP) | 2003-08-27 | — | — | EP | disclosed |
| US-6281389-B1 | MIXING WITH SOLVENT; DISTILLATION | NIPPON SHOKUBAI CO., LTD. (JP) | 2001-08-28 | — | — | US | disclosed |
| EP-0985672-A2 | Method for purifying tetrakis(fluoroaryl)borate compounds | Nippon Shokubai Co., Ltd. (JP) | 2000-03-15 | — | — | EP | disclosed |