Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | XIAP | P98170 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 4/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 4/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | AGER | Q15109 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9346433 | 1.00 | RAB9A (0.51) | RAB9ALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL9344964 | 1.00 | RAB9A (0.51) | RAB9ALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL9345462 | 1.00 | RAB9A (0.51) | RAB9ALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL9346420 | 1.00 | RAB9A (0.51) | RAB9ALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL9349396 | 1.00 | RAB9A (0.51) | RAB9ALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL9344974 | 1.00 | RAB9A (0.51) | RAB9ALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL9349401 | 1.00 | RAB9A (0.51) | RAB9ALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL9349376 | 1.00 | RAB9A (0.51) | RAB9ALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL9349359 | 1.00 | RAB9A (0.51) | RAB9ALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL9346368 | 0.99 | RAB9A (0.52) | RAB9ALMNAMAPTKDM4ESMN1; SMN2 |
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-0344557-B1 | Liquid crystal components with a trimethylenoxy group | HOFFMANN LA ROCHE (CH) | 1994-08-10 | — | — | EP | disclosed |
| US-5238600-A | IBIMETHYLENOXY CONTAINING LIQUID CRYSTAL COMPOUNDS | HOFFMANN-LA ROCHE INC. (US) | 1993-08-24 | — | — | US | disclosed |
| EP-0344557-A2 | Liquid crystal components with a trimethylenoxy group | F. HOFFMANN-LA ROCHE AG (CH) | 1989-12-06 | — | — | EP | disclosed |