⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL991839 | 0.97 | — | — | |
| SCHEMBL28756 | 0.97 | — | — | |
| SCHEMBL360594 | 0.97 | — | — | |
| Ethane SCHEMBL9471005 | 0.94 | GPR84 (0.62) | — | |
| SCHEMBL29032357 | 0.94 | — | — | |
| Charcoal, Activated SCHEMBL10763313 | 0.94 | — | — | |
| SCHEMBL27693845 | 0.94 | — | — | |
| SCHEMBL28432541 | 0.94 | — | — | |
| Methane SCHEMBL28876829 | 0.94 | — | — | |
| SCHEMBL27693842 | 0.94 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5500668-A | INK JET PRINTING | XEROX CORPORATION (US) | 1996-03-19 | — | — | US | claimed |
| CN-101194020-A | Process for producing L-amino acid | DAICEL CHEM (JP) | 2008-06-04 | — | — | CN | disclosed |
| CN-1326968-C | Heat transfer medium and its preparation method and use | NEW WORLD ZGM CO LTD (VG) | 2007-07-18 | — | — | CN | disclosed |
| CN-1654589-A | Heat transfer medium and its preparation method and use | NEW WORLD ZGM CO LTD (VG) | 2005-08-17 | — | — | CN | disclosed |
| CN-1067429-A | The 4-substituted alkyl carbapenem antibiotics | BRISTOL MYERS SQUIBB CO (US) | 1992-12-30 | — | — | CN | disclosed |