⚠ 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 | |
|---|---|---|---|---|
| Diphenylether SCHEMBL29208899 | 0.74 | LTA4H (0.92) | — | |
| SCHEMBL1907884 | 0.71 | — | — | |
| SCHEMBL8326282 | 0.71 | — | — | |
| Diphenylether SCHEMBL2461810 | 0.69 | LTA4H (1.00) | — | |
| SCHEMBL14905 | 0.69 | LTA4H (0.60) | — | |
| Diphenylether SCHEMBL4950525 | 0.69 | LTA4H (1.00) | — | |
| Diphenylether SCHEMBL9061108 | 0.69 | LTA4H (1.00) | — | |
| Diphenylether SCHEMBL12286 | 0.69 | LTA4H (1.00) | — | |
| SCHEMBL11745259 | 0.69 | LTA4H (0.80) | — | |
| Hydrochloric Acid SCHEMBL17135610 | 0.69 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102762630-A | Green soluble conjugated polymers with high carrier mobility | UNIV FLORIDA | 2012-10-31 | — | — | CN | claimed |
| CN-102762630-A | Green soluble conjugated polymers with high carrier mobility | UNIV FLORIDA | 2012-10-31 | — | — | CN | disclosed |