Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11522674 | 0.75 | ALDH1A1 (0.38) | ALDH1A1TSHRTP53 | |
| SCHEMBL11028003 | 0.67 | ALDH1A1 (0.31) | ALDH1A1TSHRTP53 | |
| SCHEMBL5944823 | 0.64 | — | — | |
| Dalapon SCHEMBL4895986 | 0.63 | TSHR (0.57) | ALDH1A1TSHRTP53 | |
| Dalapon SCHEMBL45164 | 0.63 | — | — | |
| SCHEMBL301323 | 0.63 | — | — | |
| SCHEMBL1678472 | 0.63 | TSHR (0.57) | ALDH1A1TSHRTP53 | |
| SCHEMBL29613223 | 0.62 | CYP1A2 (0.60) | ALDH1A1TSHR | |
| SCHEMBL305060 | 0.62 | CYP1A2 (0.60) | ALDH1A1TSHR | |
| Dalapon SCHEMBL4446142 | 0.60 | — | — |
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-4141912-A | Process for the preparation of polyhalobenzylic disulfooxonium compounds | HOOKER CHEMICALS & PLASTICS CORP. (US) | 1979-02-27 | — | — | US | disclosed |
| US-4075238-A | Polyhalobenzylic disulfooxonium compounds | HOOKER CHEMICALS & PLASTICS CORPORATION (US) | 1978-02-21 | — | — | US | disclosed |