Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1256668 | 0.74 | CES2 (0.36) | CES2CES1NFE2L2 | |
| SCHEMBL9010529 | 0.72 | CES2 (0.36) | CES2CES1 | |
| SCHEMBL1454329 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL7771890 | 0.69 | NPC1 (0.35) | CES2CES1NFE2L2 | |
| Iodide SCHEMBL4049605 | 0.67 | CA1 (0.36) | CES2CES1 | |
| Zinc Chloride SCHEMBL27752365 | 0.67 | CES2 (0.34) | CES2CES1NFE2L2 | |
| SCHEMBL29443091 | 0.65 | — | — | |
| SCHEMBL530450 | 0.65 | — | — | |
| SCHEMBL2823745 | 0.65 | HTT (0.42) | CES2CES1 | |
| Iodide SCHEMBL2216576 | 0.65 | ACHE (0.41) | CES2CES1NFE2L2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0682031-B1 | Silacyclohexane-based carbaldehyde compounds and processes for preparing silacyclohexane-based liquid crystal compounds from the carbaldehyde compound | SHINETSU CHEMICAL CO (JP) | 2000-03-22 | — | — | EP | disclosed |
| EP-0692485-B1 | Cyclohexane carbaldehyde compounds and processes for preparing silacyclohexane-based liquid crystal compounds from the carbaldehyde compound | SHINETSU CHEMICAL CO (JP) | 2000-01-05 | — | — | EP | disclosed |
| US-5582765-A | Triflate compounds and process for preparing silacyclohexane-based liquid crystal compounds from the triflate compounds | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-12-10 | — | — | US | disclosed |
| US-5527490-A | Silacyclohexane carbaldehyde compounds and processes for preparing silacyclohexane-based liquid crystal compounds from the carbaldehyde compound | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-06-18 | — | — | US | disclosed |
| US-5519156-A | Cyclohexane carbaldehyde compounds and processes for preparing silacyclohexane-based liquid crystal compounds from the carbaldehyde | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-05-21 | — | — | US | disclosed |
| EP-0700919-A2 | Triflate compounds and process for preparing silacyclohexane-based liquid crystal compounds from the triflate compounds | Shin-Etsu Chemical Co., Ltd. (JP) | 1996-03-13 | — | — | EP | disclosed |
| EP-0692485-A1 | Cyclohexane carbaldehyde compounds and processes for preparing silacyclohexane-based liquid crystal compounds from the carbaldehyde compound | Shin-Etsu Chemical Co., Ltd. (JP) | 1996-01-17 | — | — | EP | disclosed |
| EP-0682031-A1 | Silacyclohexane carbaldehyde compounds and processes for preparing silycyclohexane-based liquid crystal compounds from the carbaldehyde compound | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1995-11-15 | — | — | EP | disclosed |