⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9801151 | 0.98 | TSHR (0.30) | — | |
| SCHEMBL9801490 | 0.95 | — | — | |
| SCHEMBL27864183 | 0.74 | — | — | |
| SCHEMBL3672874 | 0.74 | — | — | |
| SCHEMBL29210920 | 0.74 | — | — | |
| SCHEMBL25272812 | 0.72 | — | — | |
| SCHEMBL3667016 | 0.72 | — | — | |
| SCHEMBL6061601 | 0.72 | — | — | |
| SCHEMBL3672766 | 0.70 | — | — | |
| SCHEMBL3672444 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20070179227-A1 | VOC-free water reducible coating vehicles | VOCFREE, INC. | 2007-08-02 | — | — | US | disclosed |
| EP-1626815-A1 | VOC FREE WATER REDUCIBLE COATING VEHICLES | Vocfree, Inc. (US) | 2006-02-22 | — | — | EP | disclosed |
| WO-2004105963-A1 | VOC FREE WATER REDUCIBLE COATING VEHICLES | VOCFREE, INC. (US) | 2004-12-09 | — | — | WO | disclosed |
| US-4992150-A | Telomer with alpha-olefin;oil and fuel additive | NIPPON OIL CO, LTD. (JP) | 1991-02-12 | — | — | US | disclosed |