⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2222142 | 0.88 | — | — | |
| SCHEMBL9602638 | 0.87 | — | — | |
| SCHEMBL8932503 | 0.83 | — | — | |
| SCHEMBL6829811 | 0.83 | — | — | |
| SCHEMBL28221535 | 0.83 | — | — | |
| SCHEMBL515663 | 0.83 | GSR (0.35) | — | |
| SCHEMBL20435375 | 0.83 | LMNA (0.43) | — | |
| SCHEMBL6520969 | 0.79 | LMNA (0.35) | — | |
| SCHEMBL5695584 | 0.77 | SLC22A6 (0.35) | — | |
| SCHEMBL20329626 | 0.76 | TSHR (0.35) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8097609-B2 | Swallowtail motifs for imparting water solubility to porphyrinic compounds | NORTH CAROLINA STATE UNIVERSITY (US) | 2012-01-17 | — | — | US | disclosed |
| US-20090297456-A1 | SWALLOWTAIL MOTIFS FOR IMPARTING WATER SOLUBILITY TO PORPHYRINIC COMPOUNDS | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2009-12-03 | — | — | US | disclosed |
| EP-1984380-A1 | PROCESS TO PREPARE METAL COMPLEX OF N,N-BIS(2-HYDROXYETHYL)GLYCINE | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2008-10-29 | — | — | EP | disclosed |
| WO-2007094826-A1 | PROCESS TO PREPARE METAL COMPLEX OF N,N-BIS(2-HYDROXYETHYL)GLYCINE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2007-08-23 | — | — | WO | disclosed |