Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | PGK1 | P00558 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CD44 | P16070 | 1/20 | 0.30 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL25658874 | 0.82 | NPC1 (0.63) | NPC1GAAALDH1A1CD44 | |
| SCHEMBL10585829 | 0.82 | GAA (0.47) | NPC1GAAPOLBALDH1A1CD44 | |
| SCHEMBL1224878 | 0.80 | NPC1 (0.67) | NPC1GAAPOLBALDH1A1TAAR1 | |
| SCHEMBL8600593 | 0.77 | ELANE (0.36) | NPC1GAAPOLBAPEX1 | |
| SCHEMBL8599602 | 0.76 | PPOX (0.45) | NPC1GAAPOLBALDH1A1 | |
| SCHEMBL4678114 | 0.76 | PPOX (0.45) | NPC1GAAPOLBALDH1A1 | |
| SCHEMBL8598548 | 0.74 | LMNA (0.46) | NPC1POLBALDH1A1 | |
| SCHEMBL10811265 | 0.73 | NPC1 (0.38) | NPC1GAAPOLBALDH1A1 | |
| SCHEMBL9872059 | 0.73 | NPC1 (0.43) | NPC1GAAPOLBALDH1A1TAAR1 | |
| SCHEMBL8879333 | 0.73 | NPC1 (0.43) | NPC1GAATAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0626370-B1 | Process for producing aromatic isothiocyanate derivatives | SUMITOMO CHEMICAL CO (JP) | 1998-02-11 | — | — | EP | disclosed |
| EP-0626370-A1 | Process for producing aromatic isothiocyanate derivatives | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1994-11-30 | — | — | EP | disclosed |