Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.41 |
| ▸ | RELA | Q04206 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | RARA | P10276 | 1/20 | 0.41 |
| ▸ | RARG | P13631 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.39 |
| ▸ | CTRC | Q99895 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | BRS3 | P32247 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774917 | 0.96 | RARB (0.51) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL8774251 | 0.95 | RARB (0.53) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL8774831 | 0.95 | RARB (0.53) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL8774671 | 0.93 | NPC1 (0.42) | RARBRAB9ASMN1; SMN2NPC1RARA | |
| SCHEMBL8775178 | 0.87 | FEN1 (0.38) | GRM2 | |
| SCHEMBL8774724 | 0.86 | AKR1C2 (0.50) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL9155955 | 0.85 | RARB (0.48) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL9879667 | 0.83 | RARB (0.46) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL19253582 | 0.82 | RARB (0.56) | RARBRARARARGAKR1C2AKR1C1 | |
| SCHEMBL19253584 | 0.82 | RARB (0.56) | RARBRARARARGAKR1C2AKR1C1 |
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-0519370-B1 | Heterocyclic derivatives | MERCK PATENT GMBH (DE) | 1997-11-05 | — | — | EP | disclosed |
| EP-0519370-A2 | Heterocyclic derivatives | MERCK PATENT GmbH (DE) | 1992-12-23 | — | — | EP | disclosed |