⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL915494 | 0.77 | MEN1 (0.34) | — | |
| SCHEMBL16021800 | 0.74 | DPP4 (0.39) | — | |
| SCHEMBL9965661 | 0.72 | — | — | |
| SCHEMBL10035949 | 0.70 | — | — | |
| SCHEMBL21291337 | 0.69 | PGR (0.33) | — | |
| SCHEMBL14838325 | 0.69 | HSD17B1 (0.38) | — | |
| SCHEMBL14838253 | 0.69 | HDAC1 (0.33) | — | |
| SCHEMBL14838249 | 0.68 | HDAC1 (0.31) | — | |
| SCHEMBL14838258 | 0.68 | ALDH1A1 (0.34) | — | |
| SCHEMBL10035948 | 0.66 | LTA4H (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012079160-A1 | VARIABLE TRANSMITTANCE OPTICAL FILTER WITH SUBSTANTIALLY CO- PLANAR ELECTRODE SYSTEM | SWITCH MATERIALS, INC. (CA) | 2012-06-21 | — | — | WO | disclosed |