⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5537573 | 0.84 | NR1I2 (0.30) | — | |
| SCHEMBL48010 | 0.84 | LMNA (0.31) | — | |
| SCHEMBL641157 | 0.73 | ALDH1A1 (0.30) | — | |
| SCHEMBL641792 | 0.72 | PRKCA (0.38) | — | |
| SCHEMBL16986022 | 0.72 | — | — | |
| SCHEMBL13881086 | 0.71 | ALDH1A1 (0.34) | — | |
| SCHEMBL14003898 | 0.71 | PRKCA (0.31) | — | |
| SCHEMBL8776584 | 0.70 | TSHR (0.38) | — | |
| SCHEMBL732557 | 0.70 | NR1I2 (0.31) | — | |
| SCHEMBL7673145 | 0.69 | PRKCA (0.35) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6315918-B1 | CAPACITOR HAVING HIGH ENERGY DENSITY AND EXCELLENT WITH-STAND VOLTAGE AND CHARGING/DISCHARGING CYCLE PROPERTIES, AND SAFETY PERFORMANCE | MITSUI CHEMICALS INC. (JP) | 2001-11-13 | — | — | US | disclosed |