Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29007494 | 0.79 | — | — | |
| SCHEMBL16941870 | 0.77 | TSHR (0.35) | TSHRALDH1A1TP53 | |
| SCHEMBL7690034 | 0.77 | ACLY (0.42) | TSHRALDH1A1TP53 | |
| SCHEMBL61462 | 0.75 | — | — | |
| SCHEMBL28661533 | 0.75 | TSHR (0.38) | TSHRALDH1A1TP53 | |
| SCHEMBL16385276 | 0.74 | TSHR (0.33) | TSHRALDH1A1TP53 | |
| SCHEMBL24410838 | 0.72 | TSHR (0.38) | TSHRALDH1A1TP53 | |
| SCHEMBL1726464 | 0.72 | THRB (0.33) | TSHR | |
| SCHEMBL7170616 | 0.72 | TSHR (0.32) | TSHR | |
| SCHEMBL1649559 | 0.71 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-3123753-A | — | — | None | — | — | JP | disclosed |
| US-5093522-A | Intermediates for finishing textiles | BAYER AKTIENGESELLSCHAFT (DE) | 1992-03-03 | — | — | US | disclosed |
| JP-H03123753-A | CARBOXYLIC ACID HALIDE HAVING TRIFLUOROMETHYL GROUP AND PREPARATION OF THE SAME | BAYER AG | 1991-05-27 | — | — | JP | disclosed |