⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11764843 | 0.79 | — | — | |
| SCHEMBL837779 | 0.74 | ALDH1A1 (0.56) | — | |
| SCHEMBL3298772 | 0.73 | — | — | |
| SCHEMBL5850539 | 0.73 | ALDH1A1 (0.63) | — | |
| SCHEMBL17333478 | 0.71 | — | — | |
| SCHEMBL11879963 | 0.71 | ALDH1A1 (0.60) | — | |
| SCHEMBL50875 | 0.69 | — | — | |
| SCHEMBL5851906 | 0.69 | — | — | |
| SCHEMBL11016486 | 0.69 | — | — | |
| SCHEMBL5850684 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20100094001-A1 | COMPOSITION CONTAINING STABILITY-IMPROVED CHLOROMETHYL PHOSPHATE DERIVATIVE AND PROCESS FOR PRODUCING SAME | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2010-04-15 | — | — | US | disclosed |
| EP-2133355-A1 | COMPOSITION CONTAINING CHLOROMETHYL PHOSPHATE DERIVATIVE WITH IMPROVED STABILITY AND METHOD FOR PRODUCING THE SAME | Eisai R&D Management Co., Ltd. (JP) | 2009-12-16 | — | — | EP | disclosed |
| US-20090114877-A1 | Composition Containing Stability-Improved Chloromethyl Phosphate Derivatve and Process for Producing Same | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2009-05-07 | — | — | US | disclosed |