⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2354989 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL28858990 | 0.65 | — | — | |
| SCHEMBL28996434 | 0.58 | — | — | |
| SCHEMBL2574671 | 0.48 | — | — | |
| SCHEMBL847804 | 0.48 | — | — | |
| SCHEMBL17022301 | 0.48 | — | — | |
| SCHEMBL18721125 | 0.48 | — | — | |
| SCHEMBL905796 | 0.48 | — | — | |
| SCHEMBL12469181 | 0.48 | — | — | |
| SCHEMBL2138817 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110237499-A1 | HYBRID TRIPYRROLE-OCTAARGININE COMPOUNDS AND THEIR USE AS MEDICAMENT IN THE TREATMENT OF CANCER AND MICROBIAL ILLNESSES | UNIVERSIDADE DE SANTIAGO DE COMPOSTELA (ES) | 2011-09-29 | — | — | US | disclosed |
| EP-2336108-A1 | HYBRID TRIPYRROLE-OCTAARGININE COMPOUNDS AND THEIR USE AS MEDICAMENT IN THE TREATMENT OF CANCER AND MICROBIAL ILLNESSES | Universidade De Santiago De Compostela (ES) | 2011-06-22 | — | — | EP | disclosed |