⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15330484 | 1.00 | — | — | |
| SCHEMBL9952478 | 0.83 | — | — | |
| SCHEMBL29952647 | 0.80 | — | — | |
| SCHEMBL7735378 | 0.77 | GAPDH (0.31) | — | |
| SCHEMBL15198671 | 0.77 | TYMP (0.38) | — | |
| SCHEMBL2554814 | 0.77 | KDM4E (0.40) | — | |
| SCHEMBL4076197 | 0.76 | — | — | |
| SCHEMBL4598144 | 0.76 | — | — | |
| SCHEMBL4474143 | 0.76 | — | — | |
| SCHEMBL24464156 | 0.76 | TSHR (0.41) | — |
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-6410528-B1 | FUNGICIDES, ANTIPROTOZOA AGENT | GLAXO WELLCOME S.A. (ES) | 2002-06-25 | — | — | US | disclosed |
| EP-1077959-A1 | MORPHOLINO ETHERS | Glaxo Wellcome S.A. (ES) | 2001-02-28 | — | — | EP | disclosed |
| WO-1999058512-A1 | MORPHOLINO ETHERS | GLAXO WELLCOME S.A. (ES) | 1999-11-18 | — | — | WO | disclosed |