⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL222574 | 0.77 | — | — | |
| SCHEMBL18028187 | 0.68 | — | — | |
| SCHEMBL2480106 | 0.67 | — | — | |
| SCHEMBL2527911 | 0.65 | CTSA (0.39) | — | |
| SCHEMBL27690196 | 0.64 | LMNA (0.31) | — | |
| SCHEMBL10002019 | 0.64 | ALDH1A1 (0.31) | — | |
| SCHEMBL2479369 | 0.64 | PPARD (0.37) | — | |
| SCHEMBL14827470 | 0.64 | PPARD (0.31) | — | |
| SCHEMBL874478 | 0.62 | — | — | |
| SCHEMBL28581452 | 0.61 | FDPS (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9997805-B2 | — | — | 2018-06-12 | — | — | US | disclosed |
| US-20160240888-A1 | ELECTROLYTE AND LITHIUM-ION SECONDARY BATTERY | ASAHI KASEI KABUSHIKI KAISHA (JP) | 2016-08-18 | — | — | US | disclosed |