Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8027799 | 0.95 | SPHK1 (0.37) | SPHK1DRD2SLC18A3HTR7 | |
| SCHEMBL7757153 | 0.91 | DRD2 (0.35) | DRD2NPC1RAB9ASLC18A3MAOA | |
| SCHEMBL8581098 | 0.87 | ESR2 (0.36) | SPHK1NPC1RAB9A | |
| SCHEMBL8579023 | 0.87 | RARB (0.32) | SPHK1NPC1RAB9ASLC18A3 | |
| SCHEMBL7757610 | 0.86 | CYP2C9 (0.41) | SPHK1DRD2NPC1RAB9A | |
| SCHEMBL7757605 | 0.86 | CYP2C9 (0.41) | SPHK1DRD2NPC1RAB9A | |
| SCHEMBL8580118 | 0.86 | RARB (0.34) | SPHK1DRD2NPC1RAB9ASLC18A3 | |
| SCHEMBL8578901 | 0.86 | RARB (0.34) | SPHK1DRD2NPC1RAB9ASLC18A3 | |
| SCHEMBL8944875 | 0.84 | CYP3A4 (0.31) | — | |
| SCHEMBL7755480 | 0.84 | ESR2 (0.40) | — |
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-0696591-B1 | Process for preparing silacyclohexane-based liquid crystal compounds | SHINETSU CHEMICAL CO (JP) | 2001-03-14 | — | — | EP | disclosed |
| US-5514824-A | Process for preparing silacyclohexane-base liquid crystal compounds | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-05-07 | — | — | US | disclosed |
| EP-0696591-A1 | Process for preparing silacyclohexane-based liquid crystal compounds | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-02-14 | — | — | EP | disclosed |