Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | HPSE | Q9Y251 | 17/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL6821837 | 0.88 | NPC1 (0.67) | KDM4ENPC1ALDH1A1MAPK1HPSE | |
| SCHEMBL6821845 | 0.87 | KDM4E (0.61) | KDM4ENPC1ALDH1A1MAPK1HPSE | |
| SCHEMBL6824973 | 0.84 | NPC1 (0.57) | KDM4ENPC1ALDH1A1MAPK1HPSE | |
| SCHEMBL20515129 | 0.82 | KDM4E (0.56) | KDM4ENPC1ALDH1A1MAPK1HPSE | |
| SCHEMBL6821781 | 0.82 | NPC1 (0.62) | KDM4ENPC1ALDH1A1MAPK1HPSE | |
| SCHEMBL19029344 | 0.81 | HDAC6 (0.61) | KDM4ENPC1ALDH1A1HDAC6 | |
| SCHEMBL6818285 | 0.81 | NPC1 (0.67) | KDM4ENPC1ALDH1A1MAPK1HPSE | |
| SCHEMBL6818487 | 0.81 | HPSE (0.56) | KDM4ENPC1ALDH1A1MAPK1HPSE | |
| SCHEMBL14581704 | 0.80 | KDM4E (0.66) | KDM4ENPC1ALDH1A1MAPK1HPSE | |
| SCHEMBL6822259 | 0.79 | KDM4E (0.61) | KDM4ENPC1ALDH1A1MAPK1HPSE |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004046122-A2 | BENZOXAZOLE, BENZTHIAZOLE AND BENZIMIDAZOLE ACID DERIVATIVES AND THEIR USE AS HEPARANASE INHIBITORS | OXFORD GLYCOSCIENCES (UK) LTD (GB) | 2004-06-03 | — | — | WO | disclosed |