⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2331102 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL29076605 | 0.77 | — | — | |
| SCHEMBL17598712 | 0.72 | — | — | |
| SCHEMBL14872087 | 0.72 | — | — | |
| SCHEMBL1268924 | 0.72 | — | — | |
| SCHEMBL15216216 | 0.72 | — | — | |
| SCHEMBL21846549 | 0.72 | — | — | |
| SCHEMBL8375444 | 0.72 | — | — | |
| SCHEMBL3111402 | 0.68 | — | — | |
| SCHEMBL291737 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1956026-B1 | IONIC LIQUID CONTAINING PHOSPHONIUM CATION HAVING P-N BOND AND METHOD FOR PRODUCING SAME | KANTO DENKA KOGYO KK (JP) | 2016-11-30 | — | — | EP | disclosed |
| EP-2570481-A1 | Materials and methods for efficient succinate and malate production | University of Florida Research Foundation, Inc. (US) | 2013-03-20 | — | — | EP | disclosed |
| CN-1261442-C | Method for producing glufosinates and intermediate products for same | HOECHST SCHERING AGREVO GMBH (DE) | 2006-06-28 | — | — | CN | disclosed |
| WO-1999046271-A1 | SUBSTITUTED AMINOMETHYLPHOSPHINES AS LIGANDS FOR CATALYSTS | SYMYX TECHNOLOGIES, INC. (US) | 1999-09-16 | — | — | WO | disclosed |