Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL22629293 | 0.80 | L3MBTL3 (0.37) | ALDH1A1TSHRL3MBTL3 | |
| SCHEMBL22630352 | 0.80 | L3MBTL3 (0.37) | ALDH1A1TSHRL3MBTL3 | |
| SCHEMBL6649882 | 0.80 | L3MBTL3 (0.37) | ALDH1A1TSHRL3MBTL3 | |
| SCHEMBL10046702 | 0.79 | APLNR (0.39) | ALDH1A1TSHRL3MBTL3 | |
| SCHEMBL24161967 | 0.79 | APLNR (0.39) | ALDH1A1TSHRL3MBTL3 | |
| SCHEMBL20356300 | 0.77 | L3MBTL3 (0.31) | L3MBTL3 | |
| Hydrochloric Acid SCHEMBL16039214 | 0.77 | APLNR (0.37) | ALDH1A1TSHRL3MBTL3 | |
| SCHEMBL16037703 | 0.73 | CHRNB2 (0.50) | — | |
| SCHEMBL4380987 | 0.73 | CYP2D6 (0.30) | TSHR | |
| SCHEMBL890411 | 0.73 | CYP2D6 (0.30) | TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022072634-A1 | BICYCLIC COMPOUNDS FOR USE IN THE TREATMENT CANCER | SCORPION THERAPEUTICS, INC. (US) | 2022-04-07 | — | — | WO | disclosed |
| WO-2021259331-A1 | EIGHT-MEMBERED N-CONTAINING HETEROCYCLIC COMPOUND | 南京明德新药研发有限公司 | 2021-12-30 | — | — | WO | disclosed |