⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3892367 | 0.69 | — | — | |
| SCHEMBL2163069 | 0.64 | — | — | |
| SCHEMBL12966447 | 0.64 | — | — | |
| SCHEMBL10983659 | 0.64 | — | — | |
| SCHEMBL15541274 | 0.62 | — | — | |
| SCHEMBL8237647 | 0.60 | — | — | |
| SCHEMBL3348276 | 0.58 | — | — | |
| SCHEMBL91888 | 0.51 | — | — | |
| SCHEMBL22637 | 0.51 | — | — | |
| SCHEMBL125675 | 0.51 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102216316-A | Substituted amine derivative and medicinal composition comprising same as the active ingredient | KOTOBUKI PHARMACEUTICAL CO LTD | 2011-10-12 | — | — | CN | disclosed |
| CN-101641338-A | Multifunctional small molecules as antiproliferative agents | CURIS INC US | 2010-02-03 | — | — | CN | disclosed |
| CN-101293867-A | Phenylalanine enamide derivatives possessing a cyclobutene group, for use as integrin inhibitors | CELLTECH R&D LTD (GB) | 2008-10-29 | — | — | CN | disclosed |
| CN-100400513-C | Phenylalanine enamide derivatives containing cyclobutene groups for use as integrin inhibitors | CELLTECH R&D LTD (GB) | 2008-07-09 | — | — | CN | disclosed |
| CN-100390179-C | Arylamine substituted bicyclic heteroaromatic compounds as p38 kinase inhibitors | CELLTECH R&D LTD (GB) | 2008-05-28 | — | — | CN | disclosed |
| CN-1293040-C | Process for preparing phenylalanine enamide derivatives | CELLTECH R&D LTD (GB) | 2007-01-03 | — | — | CN | disclosed |
| CN-1809575-A | Thienopyridone derivatives as kinase inhibitors | CELLTECH R&D LTD (GB) | 2006-07-26 | — | — | CN | disclosed |
| EP-1608735-A2 | IRNA CONJUGATES | Alnylam Pharmaceuticals (US) | 2005-12-28 | — | — | EP | disclosed |
| CN-1671715-A | Arylamine substituted bicyclic heteroaromatic compounds as p38 kinase inhibitors | CELLTECH R&D LTD (GB) | 2005-09-21 | — | — | CN | disclosed |
| CN-1668574-A | Process for preparing phenylalanine enamide derivatives | CELLTECH R&D LTD (GB) | 2005-09-14 | — | — | CN | disclosed |
| CN-1636999-A | Benzobisazole-base compound | MITSUI CHEMICALS INC (JP) | 2005-07-13 | — | — | CN | disclosed |
| CN-1582276-A | Phenylalanine enamide derivatives | CELLTECH R&D LTD (GB) | 2005-02-16 | — | — | CN | disclosed |
| WO-2004090108-A2 | IRNA CONJUGATES | ALNYLAM PHARMACEUTICALS (US) | 2004-10-21 | — | — | WO | disclosed |