⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24359433 | 0.88 | HRH3 (0.32) | — | |
| SCHEMBL2493465 | 0.88 | HRH3 (0.32) | — | |
| SCHEMBL2499595 | 0.84 | CA12 (0.35) | — | |
| SCHEMBL863172 | 0.82 | — | — | |
| SCHEMBL5892413 | 0.82 | — | — | |
| SCHEMBL16853726 | 0.81 | MEN1 (0.37) | — | |
| SCHEMBL24581181 | 0.79 | — | — | |
| SCHEMBL2494844 | 0.79 | CA12 (0.33) | — | |
| SCHEMBL2494291 | 0.76 | MEN1 (0.32) | — | |
| SCHEMBL12663243 | 0.76 | MEN1 (0.37) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2072496-B1 | METHOD FOR PRODUCING HIGH-PURITY QUATERNARY AMMONIUM SALT | OTSUKA CHEMICAL CO LTD (JP) | 2017-11-15 | — | — | EP | disclosed |
| CN-101516829-B | Method for producing high-purity quaternary ammonium salt | OTSUKA CHEMICAL CO LTD | 2013-01-16 | — | — | CN | disclosed |
| CN-101516862-B | Method for producing high-purity quaternary ammonium salt | OTSUKA CHEMICAL CO.,LTD. (JP) | 2012-02-01 | — | — | CN | disclosed |
| US-8029690-B2 | Process for production of highly pure quaternary ammonium salt | OTSUKA CHEMICAL CO., LTD. (JP) | 2011-10-04 | — | — | US | disclosed |
| US-8029689-B2 | Method for producing high-purity quaternary ammonium salt | OTSUKA CHEMICAL CO., LTD. (JP) | 2011-10-04 | — | — | US | disclosed |
| US-20100044617-A1 | Method for producing high-purity quaternary ammonium salt | STELLA CHEMIFA CORPORATION (JP) | 2010-02-25 | — | — | US | disclosed |
| US-20090272933-A1 | Process for production of highly pure quaternary ammonium salt | STELLA CHEMIFA CORPORATION (JP) | 2009-11-05 | — | — | US | disclosed |
| EP-2098518-A1 | PROCESS FOR PRODUCTION OF HIGHLY PURE QUATERNARY AMMONIUM SALT | Otsuka Chemical Co., Ltd. (JP) | 2009-09-09 | — | — | EP | disclosed |
| CN-101516829-A | Method for producing high-purity quaternary ammonium salt | OTSUKA CHEMICAL CO LTD (JP) | 2009-08-26 | — | — | CN | disclosed |
| CN-101516862-A | Method for producing high-purity quaternary ammonium salt | OTSUKA CHEMICAL CO LTD (JP) | 2009-08-26 | — | — | CN | disclosed |
| EP-2072496-A1 | METHOD FOR PRODUCING HIGH-PURITY QUATERNARY AMMONIUM SALT | Otsuka Chemical Co., Ltd. (JP) | 2009-06-24 | — | — | EP | disclosed |