Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | TYR | P14679 | 1/20 | 0.32 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.31 |
| ▸ | STAT3 | P40763 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7077258 | 0.80 | — | — | |
| SCHEMBL7093946 | 0.80 | TTR (0.40) | TYMSALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL17894508 | 0.78 | TDP1 (0.43) | TYMSALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL8778659 | 0.73 | TYMS (0.33) | TYMS | |
| SCHEMBL8988302 | 0.72 | STAT3 (0.53) | ALDH1A1TSHRHSD17B10TDP1STAT3 | |
| SCHEMBL10939238 | 0.71 | ALDH1A1 (0.50) | ALDH1A1TSHRHSD17B10TDP1STAT3 | |
| SCHEMBL1823917 | 0.68 | ALDH1A1 (0.61) | ALDH1A1TSHRHSD17B10TDP1STAT3 | |
| SCHEMBL2747236 | 0.68 | ALDH1A1 (0.52) | ALDH1A1TSHRHSD17B10TDP1STAT3 | |
| SCHEMBL7253446 | 0.68 | ALDH1A1 (0.51) | ALDH1A1TDP1STAT3 | |
| SCHEMBL10430139 | 0.67 | TYMS (0.55) | TYMSALDH1A1HSD17B10TDP1 |
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-0285985-A1 | 3-Substituted 1-(2-chlorothiazol-5-yl-methyl)-2-nitroimino-1,3-diazacycloalkanes | BAYER AG (DE) | 1988-10-12 | — | — | EP | disclosed |