⚠ 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 | |
|---|---|---|---|---|
| Methoxymethane SCHEMBL16998540 | 0.82 | — | — | |
| Methoxymethane SCHEMBL868 | 0.82 | — | — | |
| Methoxymethane SCHEMBL5707121 | 0.82 | — | — | |
| Methoxymethane SCHEMBL12190176 | 0.82 | — | — | |
| Methoxymethane SCHEMBL23300783 | 0.73 | — | — | |
| Methoxymethane SCHEMBL4447861 | 0.73 | — | — | |
| Methoxymethane SCHEMBL727682 | 0.73 | — | — | |
| Methoxymethane SCHEMBL23803961 | 0.73 | — | — | |
| Methoxymethane SCHEMBL17377404 | 0.73 | — | — | |
| Methoxymethane SCHEMBL1281599 | 0.73 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100554336-C | A kind of preparation method of active blue dyestuff | HUBEI HUALI DYE INDUSTRY CO LT (CN) | 2009-10-28 | — | — | CN | claimed |
| CN-101054476-A | Method for preparing active blue dyestuff | HUBEI HUALI DYE INDUSTRY CO LT (CN) | 2007-10-17 | — | — | CN | claimed |
| CN-100554336-C | A kind of preparation method of active blue dyestuff | HUBEI HUALI DYE INDUSTRY CO LT (CN) | 2009-10-28 | — | — | CN | disclosed |
| CN-100554336-C | A kind of preparation method of active blue dyestuff | HUBEI HUALI DYE INDUSTRY CO LT (CN) | 2009-10-28 | — | — | CN | disclosed |
| CN-101054476-A | Method for preparing active blue dyestuff | HUBEI HUALI DYE INDUSTRY CO LT (CN) | 2007-10-17 | — | — | CN | disclosed |
| CN-1082956-C | Melagatran (Micacocidin) derivatives | SHONONNGI & CO LTD (JP) | 2002-04-17 | — | — | CN | disclosed |
| CN-1215394-A | Melagatran (Micacocidin) derivatives | SHIONOGI & CO (JP) | 1999-04-28 | — | — | CN | disclosed |
| US-4828959-A | FOR PLANOGRAPHIC PRINTING PLATES | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-05-09 | — | — | US | disclosed |