⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7901685 | 0.80 | TSHR (0.37) | — | |
| SCHEMBL3501156 | 0.78 | — | — | |
| SCHEMBL5480087 | 0.76 | GPR84 (0.45) | — | |
| SCHEMBL15153583 | 0.75 | GPR84 (0.48) | — | |
| SCHEMBL3501372 | 0.75 | GPR84 (0.48) | — | |
| SCHEMBL4977789 | 0.75 | GPR84 (0.48) | — | |
| SCHEMBL21134014 | 0.75 | CA12 (0.35) | — | |
| SCHEMBL2818859 | 0.75 | GPR84 (0.48) | — | |
| SCHEMBL8402045 | 0.75 | GPR84 (0.48) | — | |
| SCHEMBL11363078 | 0.75 | GPR84 (0.48) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5476962-A | New lipopolyamines, their preparation and their use | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 1995-12-19 | — | — | US | claimed |
| EP-1546263-B1 | ACID RED 82 IN MIXTURES | LANXESS DEUTSCHLAND GMBH (DE) | 2007-10-03 | — | — | EP | disclosed |
| US-7193085-B2 | Acid Red 82 in mixtures | LANXESS DEUTSCHLAND GMBH (DE) | 2007-03-20 | — | — | US | disclosed |
| US-20060144289-A1 | Acid red 82 in mixtures | LANXESS DEUTSCHLAND GMBH (DE) | 2006-07-06 | — | — | US | disclosed |
| EP-1546263-A1 | ACID RED 82 IN MIXTURES | Lanxess Deutschland GmbH (DE) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004031301-A1 | ACID RED 82 IN MIXTURES | LANXESS DEUTSCHLAND GMBH (DE) | 2004-04-15 | — | — | WO | disclosed |
| US-5476962-A | New lipopolyamines, their preparation and their use | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 1995-12-19 | — | — | US | disclosed |