⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL505454 | 1.00 | — | — | |
| SCHEMBL597792 | 0.92 | TSHR (0.31) | — | |
| Bromide SCHEMBL367567 | 0.90 | TSHR (0.30) | — | |
| Iodide SCHEMBL1458237 | 0.90 | TSHR (0.30) | — | |
| Hydrochloric Acid SCHEMBL366958 | 0.90 | TSHR (0.30) | — | |
| SCHEMBL16163417 | 0.89 | — | — | |
| SCHEMBL506437 | 0.83 | — | — | |
| SCHEMBL505628 | 0.83 | — | — | |
| SCHEMBL6435531 | 0.82 | LMNA (0.30) | — | |
| Thiocyanic Acid SCHEMBL14483394 | 0.82 | — | — |
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-2415913-A1 | PROCESSES FOR PRODUCING CARBON FIBER, THE FILAMENT THEREOF, AND PRE-OXIDIZED FIBER | Donghua University (CN) | 2012-02-08 | — | — | EP | claimed |
| EP-2415913-A1 | PROCESSES FOR PRODUCING CARBON FIBER, THE FILAMENT THEREOF, AND PRE-OXIDIZED FIBER | Donghua University (CN) | 2012-02-08 | — | — | EP | disclosed |
| US-20120027944-A1 | PROCESSES FOR PRODUCING CARBON FIBER, THE FILAMENT THEREOF, AND PRE-OXIDIZED FIBER | DONGHUA UNIVERSITY (CN) | 2012-02-02 | — | — | US | disclosed |