Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11521258 | 0.90 | NPC1 (0.58) | NPC1MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL11519736 | 0.88 | NPC1 (0.43) | NPC1MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL11521140 | 0.85 | CA12 (0.52) | NPC1MEN1KMT2AMAPTLMNA | |
| SCHEMBL10784629 | 0.85 | MEN1 (0.48) | NPC1MEN1KMT2AMAPTLMNA | |
| SCHEMBL11518679 | 0.85 | DHODH (0.48) | NPC1MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL11524372 | 0.84 | NPC1 (0.42) | NPC1MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL11519773 | 0.83 | MEN1 (0.39) | NPC1MEN1KMT2AMAPTLMNA | |
| SCHEMBL10786890 | 0.83 | ALDH1A1 (0.46) | NPC1MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL11522204 | 0.81 | POLB (0.47) | MEN1KMT2AALDH1A1MAPTLMNA | |
| SCHEMBL11519775 | 0.81 | BDKRB1 (0.46) | MEN1KMT2AMAPTKDM4ECA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0105196-B1 | SUBSTITUTED BENZENESULFONIC ACID ESTERS, PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-07-29 | — | — | EP | disclosed |
| US-4504490-A | Substituted benzenesulfonic esters and their use as medicaments for combatting helminths | HOECHST AKTIENGESELLSCHAFT (DE) | 1985-03-12 | — | — | US | disclosed |
| EP-0105196-A2 | Substituted benzenesulfonic acid esters, preparation thereof and their use as medicaments | HOECHST AKTIENGESELLSCHAFT (DE) | 1984-04-11 | — | — | EP | disclosed |