Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CTSS | P25774 | 6/20 | 0.44 |
| ▸ | CTSL | P07711 | 5/20 | 0.44 |
| ▸ | CTSK | P43235 | 5/20 | 0.44 |
| ▸ | CTSB | P07858 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6446301 | 0.96 | CTSS (0.46) | SMN1; SMN2NPC1RAB9ALMNACTSS | |
| SCHEMBL6449690 | 0.92 | SMN1; SMN2 (0.45) | SMN1; SMN2NPC1RAB9ALMNACTSS | |
| SCHEMBL6448203 | 0.88 | CTSS (0.48) | LMNACTSSCTSLCTSKCTSB | |
| SCHEMBL6446410 | 0.86 | CTSS (0.48) | CTSSCTSLCTSKCTSB | |
| SCHEMBL6443383 | 0.85 | CTSS (0.51) | CTSSCTSLCTSKCTSB | |
| SCHEMBL6445436 | 0.85 | CTSS (0.44) | CTSSCTSLCTSKCTSB | |
| SCHEMBL6445530 | 0.85 | CTSS (0.47) | LMNACTSSCTSLCTSKCTSB | |
| SCHEMBL6443769 | 0.82 | NPC1 (0.65) | SMN1; SMN2NPC1RAB9ALMNACTSS | |
| SCHEMBL6444043 | 0.82 | CTSS (0.62) | CTSSCTSLCTSKCTSB | |
| SCHEMBL6442470 | 0.80 | CTSK (0.45) | CTSSCTSLCTSKCTSB |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1575903-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | Jerini AG (DE) | 2005-09-21 | — | — | EP | claimed |
| WO-2004065353-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | JERINI AG (DE) | 2004-08-05 | — | — | WO | claimed |
| WO-2004056755-A2 | COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES | JERENI AG (DE) | 2004-07-08 | — | — | WO | claimed |
| EP-1575903-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | Jerini AG (DE) | 2005-09-21 | — | — | EP | disclosed |
| WO-2004065353-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | JERINI AG (DE) | 2004-08-05 | — | — | WO | disclosed |
| WO-2004056755-A2 | COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES | JERENI AG (DE) | 2004-07-08 | — | — | WO | disclosed |