⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9886715 | 1.00 | — | — | |
| SCHEMBL13550947 | 1.00 | — | — | |
| SCHEMBL28155001 | 1.00 | — | — | |
| SCHEMBL29776765 | 1.00 | — | — | |
| SCHEMBL9886648 | 1.00 | — | — | |
| SCHEMBL12189870 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL28897397 | 0.97 | — | — | |
| SCHEMBL15424097 | 0.85 | MGAM (0.32) | — | |
| SCHEMBL12471044 | 0.85 | MGAM (0.32) | — | |
| SCHEMBL21115773 | 0.85 | MGAM (0.32) | — |
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-8115020-B2 | Processes for the preparation and purification of hydroxymethylfuraldehyde and derivatives | ARCHER DANIELS MIDLAND COMPANY (US) | 2012-02-14 | — | — | US | disclosed |
| US-20110137052-A1 | Processes for the Preparation and Purification of Hydroxymethylfuraldehyde and Derivatives | ARCHER DANIELS MIDLAND COMPANY (US) | 2011-06-09 | — | — | US | disclosed |
| US-7393963-B2 | Conversion of 2,5-(hydroxymethyl)furaldehyde to industrial derivatives, purification of the derivatives, and industrial uses therefor | ARCHER-DANIELS-MIDLAND COMPANY (US) | 2008-07-01 | — | — | US | disclosed |