Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 15/20 | 0.72 |
| ▸ | RAB9A | P51151 | 15/20 | 0.72 |
| ▸ | SMN1; SMN2 | Q16637 | 9/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.72 |
| ▸ | TP53 | P04637 | 4/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.71 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.71 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.71 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.71 |
| ▸ | RELA | Q04206 | 2/20 | 0.71 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.71 |
| ▸ | LMNA | P02545 | 5/20 | 0.70 |
| ▸ | MAPT | P10636 | 5/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.70 |
| ▸ | MEN1 | O00255 | 2/20 | 0.70 |
| ▸ | GFER | P55789 | 2/20 | 0.70 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.70 |
| ▸ | GAA | P10253 | 4/20 | 0.63 |
| ▸ | KLK1 | P06870 | 1/20 | 0.62 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL6779729 | 0.91 | NPC1 (0.60) | NPC1RAB9ASMN1; SMN2KDM4ETP53 | |
| SCHEMBL31243047 | 0.84 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2KDM4ETP53 | |
| SCHEMBL7415015 | 0.84 | NPC1 (0.61) | NPC1RAB9ASMN1; SMN2KDM4ETP53 | |
| SCHEMBL16268668 | 0.84 | NPC1 (0.50) | NPC1RAB9ASMN1; SMN2KDM4ETP53 | |
| SCHEMBL14914339 | 0.83 | HDAC6 (0.51) | NPC1RAB9ASMN1; SMN2KDM4ETP53 | |
| SCHEMBL2245500 | 0.82 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2KDM4ETP53 | |
| SCHEMBL13779307 | 0.82 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2KDM4ETP53 | |
| SCHEMBL2250039 | 0.81 | NPC1 (0.77) | NPC1RAB9ASMN1; SMN2KDM4ETP53 | |
| SCHEMBL19339630 | 0.80 | HDAC6 (0.48) | NPC1RAB9ASMN1; SMN2KDM4ETP53 | |
| SCHEMBL6634815 | 0.80 | NPC1 (0.52) | NPC1RAB9ASMN1; SMN2KDM4ETP53 |
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-0966454-A1 | DISUBSTITUTED BICYCLIC HETEROCYCLES, THEIR PRODUCTION AND USE AS MEDICAMENTS | Boehringer Ingelheim Pharma KG (DE) | 1999-12-29 | — | — | EP | disclosed |
| WO-1998037075-A1 | DISUBSTITUTED BICYCLIC HETEROCYCLES, THEIR PRODUCTION AND USE AS MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1998-08-27 | — | — | WO | disclosed |