⚠ 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 | |
|---|---|---|---|---|
| Charcoal, Activated SCHEMBL526811 | 1.00 | — | — | |
| Charcoal, Activated SCHEMBL238613 | 1.00 | — | — | |
| Charcoal, Activated SCHEMBL29351837 | 1.00 | — | — | |
| Charcoal, Activated SCHEMBL5062 | 1.00 | — | — | |
| Charcoal, Activated SCHEMBL9784219 | 1.00 | — | — | |
| Charcoal, Activated SCHEMBL716063 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL6285373 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL2388451 | 0.82 | — | — | |
| Fluoride SCHEMBL10322495 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL2885163 | 0.82 | — | — |
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-6960690-B2 | Process of making a compound by forming a polymer from a template drug | MIRNS BIO CORPORATION (US) | 2005-11-01 | — | — | US | disclosed |
| WO-2002074881-A1 | A PROCESS FOR THE CATALYTIC REDUCTION OF HEAVY OILS, KEROGENS, PLASTICS, BIO - MASSES, SLUDGES, AND ORGANIC WASTE TO LIGHT HYDROCARBON LIQUIDS, CARBON DIOXIDE-AND AMINES | DEINKING/SOLVENT EXTRACTION TECHNOLOGIES LTD. (CA) | 2002-09-26 | — | — | WO | disclosed |
| US-20020085989-A1 | Process of making a compound by forming a polymer from a template drug | ROCHE MADISON INC. | 2002-07-04 | — | — | US | disclosed |