Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL584488 | 0.86 | TDP1 (0.47) | TSHRALDH1A1SMN1; SMN2GAATDP1 | |
| SCHEMBL2247156 | 0.82 | — | — | |
| SCHEMBL11382562 | 0.79 | TSHR (0.65) | TSHRALDH1A1SMN1; SMN2RECQLGAA | |
| SCHEMBL141759 | 0.79 | TSHR (0.55) | TSHRALDH1A1SMN1; SMN2RECQLGAA | |
| SCHEMBL14694110 | 0.77 | — | — | |
| SCHEMBL12355650 | 0.77 | TSHR (0.63) | TSHRALDH1A1SMN1; SMN2RECQLGAA | |
| SCHEMBL425450 | 0.77 | — | — | |
| SCHEMBL7903813 | 0.76 | — | — | |
| SCHEMBL4421305 | 0.76 | TSHR (0.55) | TSHRALDH1A1SMN1; SMN2RECQLGAA | |
| SCHEMBL425449 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2168957-B1 | Alkyl-substituted tetrahydropyranes as aromatic materials | SYMRISE AG (DE) | 2012-02-15 | — | — | EP | claimed |