⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9687690 | 0.77 | GRM7 (0.36) | — | |
| SCHEMBL9874248 | 0.72 | TP53 (0.34) | — | |
| SCHEMBL9687641 | 0.72 | TMEM97 (0.34) | — | |
| SCHEMBL9686590 | 0.71 | LMNA (0.30) | — | |
| SCHEMBL9685828 | 0.70 | TP53 (0.35) | — | |
| SCHEMBL9685668 | 0.62 | MAPT (0.38) | — | |
| SCHEMBL10474023 | 0.60 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL9687049 | 0.59 | PTGS2 (0.39) | — | |
| SCHEMBL9685792 | 0.57 | GRM7 (0.37) | — | |
| SCHEMBL9875039 | 0.54 | SMN1; SMN2 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0296416-B1 | BENZO-ANELLATED CYCLIC COMPOUNDS | NIHON BAYER AGROCHEM K.K. (JP) | 1992-07-29 | — | — | EP | disclosed |
| US-5077401-A | Herbicides | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1991-12-31 | — | — | US | disclosed |
| US-4902335-A | Benzo-fused cyclic compounds | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1990-02-20 | — | — | US | disclosed |
| EP-0296416-A1 | Benzo-anellated cyclic compounds | NIHON BAYER AGROCHEM K.K. (JP) | 1988-12-28 | — | — | EP | disclosed |