⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13839056 | 0.84 | CA1 (0.35) | — | |
| SCHEMBL10013268 | 0.81 | — | — | |
| SCHEMBL12962757 | 0.75 | — | — | |
| SCHEMBL14458792 | 0.70 | — | — | |
| SCHEMBL12166378 | 0.70 | — | — | |
| SCHEMBL12516146 | 0.70 | — | — | |
| SCHEMBL14536335 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL12069152 | 0.67 | — | — | |
| SCHEMBL15083810 | 0.67 | — | — | |
| SCHEMBL10183405 | 0.67 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3260490-A1 | COMPOSITION AND MOLDED ARTICLE | Akita University (JP) | 2017-12-27 | — | — | EP | disclosed |
| EP-3222619-A1 | CYCLIC PROTEIN TYROSINE KINASE INHIBITORS | Bristol-Myers Squibb Holdings Ireland (CH) | 2017-09-27 | — | — | EP | disclosed |
| WO-2015166295-A1 | AZOARYLS AS REVERSIBLY MODULATABLE TUBULIN INHIBITORS | ECOLE NORMALE SUPERIEURE DE LYON (FR) | 2015-11-05 | — | — | WO | disclosed |
| WO-2013081549-A1 | METHOD FOR PREPARING 2H-AZIRINE CARBOXYLIC ESTERS | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2013-06-06 | — | — | WO | disclosed |
| WO-2013022238-A2 | TRICYCLIC GLYCOSYLATED DERIVATIVE COMPOUND, A PRODUCTION METHOD THEREFOR, AND AN IMMUNOSUPPRESSANT PHARMACEUTICAL COMPOSITION COMPRISING A TACROLIMUS GLYCOSYLATION DERIVATIVE | (주)제노텍 (KR) | 2013-02-14 | — | — | WO | disclosed |
| EP-1249233-B9 | NPYY5 ANTAGONISTS | SHIONOGI & CO (JP) | 2009-08-05 | — | — | EP | disclosed |
| EP-1476550-B1 | METHOD OF SEPARATION USING AROMATIC THIOETHER LIGANDS | GE HEALTHCARE BIO SCIENCES AB (SE) | 2009-05-13 | — | — | EP | disclosed |
| EP-1249233-B1 | NPYY5 ANTAGONISTS | SHIONOGI & CO (JP) | 2008-08-20 | — | — | EP | disclosed |
| EP-1781656-B1 | ARYL-SUBSTITUTED POLYCYCLIC AMINES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT | SANOFI AVENTIS DEUTSCHLAND (DE) | 2007-12-19 | — | — | EP | disclosed |