⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16731977 | 1.00 | — | — | |
| SCHEMBL7729 | 1.00 | — | — | |
| SCHEMBL10379776 | 1.00 | — | — | |
| SCHEMBL9765580 | 1.00 | — | — | |
| SCHEMBL4956668 | 1.00 | — | — | |
| SCHEMBL8854401 | 1.00 | — | — | |
| SCHEMBL2945455 | 1.00 | — | — | |
| SCHEMBL6475092 | 1.00 | — | — | |
| SCHEMBL5488590 | 1.00 | — | — | |
| SCHEMBL2944226 | 1.00 | — | — |
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-8142756-B1 | Methods of reforming hydrocarbon fuels using hexaaluminate catalysts | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE U.S. DEPARTMENT OF ENERGY (US) | 2012-03-27 | — | — | US | disclosed |
| US-5209987-A | Adherent coating of refractory metal compound | RAYCHEM LIMITED (GB) | 1993-05-11 | — | — | US | disclosed |
| US-4985313-A | Wire and cable | RAYCHEM LIMITED (GB) | 1991-01-15 | — | — | US | disclosed |
| WO-1985000462-A1 | WIRE AND CABLE | RAYCHEM LIMITED (GB) | 1985-01-31 | — | — | WO | disclosed |