⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27532901 | 0.80 | — | — | |
| SCHEMBL2828031 | 0.76 | CHRNB2 (0.31) | — | |
| SCHEMBL2830222 | 0.72 | — | — | |
| SCHEMBL8389902 | 0.70 | EPHX1 (0.42) | — | |
| SCHEMBL11422751 | 0.70 | CHRNB2 (0.31) | — | |
| SCHEMBL11330767 | 0.69 | ALOX5 (0.33) | — | |
| SCHEMBL29277007 | 0.67 | ALOX5 (0.41) | — | |
| SCHEMBL194830 | 0.67 | ALOX5 (0.46) | — | |
| SCHEMBL27539960 | 0.67 | ALOX5 (0.33) | — | |
| SCHEMBL11041180 | 0.67 | — | — |
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-0748445-A4 | REAGENTLESS OXIDATION REACTOR | SIEVERS INSTR INC (US) | 1997-07-16 | — | — | EP | disclosed |
| EP-0748445-A1 | REAGENTLESS OXIDATION REACTOR | SIEVERS INSTRUMENTS, INC. (US) | 1996-12-18 | — | — | EP | disclosed |
| WO-1995035498-A1 | REAGENTLESS OXIDATION REACTOR | SIEVERS INSTRUMENTS, INC. (US) | 1995-12-28 | — | — | WO | disclosed |