Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 2/20 | 0.41 |
| ▸ | SHBG | P04278 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2784619 | 1.00 | TLR4 (0.41) | TLR4SHBGCA1CA2CA4 | |
| SCHEMBL7766890 | 1.00 | TLR4 (0.41) | TLR4SHBGCA1CA2CA4 | |
| SCHEMBL3247418 | 1.00 | TLR4 (0.41) | TLR4SHBGCA1CA2CA4 | |
| SCHEMBL7766897 | 1.00 | TLR4 (0.41) | TLR4SHBGCA1CA2CA4 | |
| SCHEMBL2784623 | 1.00 | TLR4 (0.41) | TLR4SHBGCA1CA2CA4 | |
| SCHEMBL7766892 | 1.00 | TLR4 (0.41) | TLR4SHBGCA1CA2CA4 | |
| SCHEMBL7766887 | 1.00 | TLR4 (0.41) | TLR4SHBGCA1CA2CA4 | |
| SCHEMBL10684281 | 0.98 | TLR4 (0.40) | TLR4SHBGCA1CA2CA4 | |
| SCHEMBL527613 | 0.93 | SHBG (0.42) | TLR4SHBGCA1CA2CA4 | |
| SCHEMBL4602788 | 0.93 | SHBG (0.42) | TLR4SHBGCA1CA2CA4 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0107759-B1 | CYCLOHEXANE DERIVATIVES AND THEIR USE AS COMPONENTS FOR LIQUID CRYSTALS | MERCK PATENT GmbH (DE) | 1992-12-16 | — | — | EP | disclosed |
| US-5108652-A | Liquid crystal dielectrics | Merck patent Gesellschaft mit beschrankter Haftung Darmstadt (DE) | 1992-04-28 | — | — | US | disclosed |
| US-4986931-A | Cyclohexane derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-01-22 | — | — | US | disclosed |
| EP-0132553-B1 | BICYCLOHEXYLES | MERCK PATENT GmbH (DE) | 1988-02-10 | — | — | EP | disclosed |
| US-4510069-A | LIQUID CRYSTALS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1985-04-09 | — | — | US | disclosed |
| EP-0107759-A2 | Cyclohexane derivatives and their use as components for liquid crystals | MERCK PATENT GmbH (DE) | 1984-05-09 | — | — | EP | disclosed |
| US-4405488-A | LOW VISCOSITY, HIGH TRANSPARENT POINT | CHISSO CORPORATION (JP) | 1983-09-20 | — | — | US | disclosed |