⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3773017 | 0.87 | — | — | |
| SCHEMBL3780328 | 0.75 | — | — | |
| SCHEMBL3776357 | 0.75 | — | — | |
| SCHEMBL76752 | 0.71 | — | — | |
| SCHEMBL5549509 | 0.71 | — | — | |
| SCHEMBL7638506 | 0.71 | — | — | |
| SCHEMBL385952 | 0.71 | — | — | |
| SCHEMBL354896 | 0.71 | — | — | |
| SCHEMBL2043516 | 0.71 | — | — | |
| SCHEMBL28233070 | 0.71 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5271917-A | Activation of carbon fiber surfaces by means of catalytic oxidation | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1993-12-21 | — | — | US | disclosed |