⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8052467 | 0.80 | TSHR (0.38) | — | |
| SCHEMBL16128269 | 0.70 | ALDH1A1 (0.31) | — | |
| SCHEMBL18721002 | 0.70 | — | — | |
| SCHEMBL10794688 | 0.69 | TSHR (0.46) | — | |
| SCHEMBL16549420 | 0.67 | — | — | |
| SCHEMBL677442 | 0.65 | TSHR (0.35) | — | |
| SCHEMBL599877 | 0.64 | TSHR (0.50) | — | |
| SCHEMBL19101383 | 0.63 | TSHR (0.33) | — | |
| SCHEMBL22594400 | 0.62 | — | — | |
| SCHEMBL18697049 | 0.61 | TSHR (0.38) | — |
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-2022015284-A1 | THERMALLY STABLE AND SOLVENT-RESISTANT CONDUCTIVE POLYMER COMPOSITES | AMBILIGHT INC. (US) | 2022-01-20 | — | — | WO | disclosed |