⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3215527 | 0.94 | — | — | |
| SCHEMBL7043871 | 0.94 | — | — | |
| SCHEMBL3219472 | 0.88 | — | — | |
| SCHEMBL3221624 | 0.80 | — | — | |
| SCHEMBL3200848 | 0.80 | — | — | |
| SCHEMBL10532842 | 0.76 | MEN1 (0.38) | — | |
| Perflubutane SCHEMBL5190215 | 0.75 | LMNA (0.41) | — | |
| Perfluorocyclobutane SCHEMBL8728333 | 0.75 | MEN1 (0.36) | — | |
| Perflubutane SCHEMBL7701005 | 0.75 | LMNA (0.41) | — | |
| SCHEMBL7051335 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7541008-B2 | Fluid reactor | UNIVERSITY OF DURHAM OF UNIVERSITY OFFICE (GB) | 2009-06-02 | — | — | US | disclosed |
| US-20050214184-A1 | Fluid reactor | UNIVERSITY OF DURHAM OF UNIVERSITY OFFICE (GB) | 2005-09-29 | — | — | US | disclosed |
| WO-2003095086-A2 | FLUID REACTOR | THE UNIVERSITY OF DURHAM (GB) | 2003-11-20 | — | — | WO | disclosed |