⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9642240 | 1.00 | — | — | |
| SCHEMBL10767859 | 0.82 | — | — | |
| SCHEMBL9718014 | 0.80 | TSHR (0.38) | — | |
| SCHEMBL9718012 | 0.80 | TSHR (0.38) | — | |
| SCHEMBL21375 | 0.76 | — | — | |
| SCHEMBL1521645 | 0.76 | — | — | |
| SCHEMBL1521644 | 0.76 | — | — | |
| SCHEMBL17266760 | 0.75 | — | — | |
| SCHEMBL11698965 | 0.74 | — | — | |
| SCHEMBL11698960 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1549669-A1 | TUMOR TARGETING AGENTS AND USES THEREOF | Karyon OY (FI) | 2005-07-06 | — | — | EP | disclosed |
| WO-2004031221-A1 | TUMOR TARGETING AGENTS AND USES THEREOF | KARYON OY (FI) | 2004-04-15 | — | — | WO | disclosed |
| US-5750540-A | SIDE EFFECT REDUCTION | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1998-05-12 | — | — | US | disclosed |
| US-5154802-A | Separating at least one alkadiene from at least one alkene using N-(beta-mercaptoethyl)-2-pyrrolidone as solvent | PHILLIPS PETROLEUM COMPANY (US) | 1992-10-13 | — | — | US | disclosed |
| US-5151161-A | N-methyl-2-thiopyrrolidone or cyclotetramethylene sulfone as solvents for extraction | PHILLIPS PETROLEUM COMPANY (US) | 1992-09-29 | — | — | US | disclosed |