⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3766855 | 1.00 | — | — | |
| SCHEMBL3778830 | 0.82 | — | — | |
| SCHEMBL15118600 | 0.81 | — | — | |
| SCHEMBL80663 | 0.81 | — | — | |
| SCHEMBL9938340 | 0.80 | TRPV1 (0.44) | — | |
| Acrylic Acid SCHEMBL27941448 | 0.80 | GABRR1 (0.43) | — | |
| SCHEMBL18533728 | 0.79 | ALDH1A1 (0.39) | — | |
| SCHEMBL21727837 | 0.79 | TRPV1 (0.38) | — | |
| SCHEMBL9184898 | 0.79 | TRPV1 (0.38) | — | |
| SCHEMBL29152441 | 0.78 | TRPV1 (0.61) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2917195-B9 | SPLICEOSTATIN ANALOGS | PFIZER (US) | 2018-05-30 | — | — | EP | disclosed |
| US-9480696-B2 | Proton-motive force stimulation to potentiate aminoglycoside antibiotics against persistent bacteria | TRUSTEES OF BOSTON UNIVERSITY (US) | 2016-11-01 | — | — | US | disclosed |
| US-20150366889-A1 | PROTON-MOTIVE FORCE STIMULATION TO POTENTIATE AMINOGLYCOSIDE ANTIBIOTICS AGAINST PERSISTENT BACTERIA | TRUSTEES OF BOSTON UNIVERSITY (US) | 2015-12-24 | — | — | US | disclosed |