Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TLR4 | O00206 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8755971 | 1.00 | CYP2C9 (0.35) | CYP2C9ALDH1A1LMNAMAPTCYP1A2 | |
| SCHEMBL8755977 | 1.00 | CYP2C9 (0.35) | CYP2C9ALDH1A1LMNAMAPTCYP1A2 | |
| SCHEMBL2207128 | 0.98 | CYP2C9 (0.36) | CYP2C9ALDH1A1LMNAMAPTCYP1A2 | |
| SCHEMBL8753103 | 0.98 | CYP2C9 (0.36) | CYP2C9ALDH1A1LMNAMAPTCYP1A2 | |
| SCHEMBL9625923 | 0.91 | TLR4 (0.38) | CYP2C9ALDH1A1LMNAMAPTCYP1A2 | |
| SCHEMBL1509950 | 0.91 | TLR4 (0.38) | CYP2C9ALDH1A1LMNAMAPTCYP1A2 | |
| SCHEMBL9625925 | 0.91 | TLR4 (0.38) | CYP2C9ALDH1A1LMNAMAPTCYP1A2 | |
| SCHEMBL8755857 | 0.87 | CYP1A2 (0.50) | CYP2C9LMNAMAPTCYP1A2TLR4 | |
| SCHEMBL8755860 | 0.87 | CYP1A2 (0.50) | CYP2C9LMNAMAPTCYP1A2TLR4 | |
| SCHEMBL8755867 | 0.87 | CYP1A2 (0.50) | CYP2C9LMNAMAPTCYP1A2TLR4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6013198-A | LIQUID CRYSTALLINE COMPOUNDS MODIFIED TO HAVE A TRIFLUOROMETHYLPHENYL GROUP OR TRIFLUOROMETHOXYPHENYL GROUP AS EXAMPLE OF KNOWN TERMINAL SUBSTITUENT; CHEMICAL STABILITY, HIGH VOLTAGE HOLDING RATIO, GOOD UV STABILITY | CHISSO CORPORATION (JP) | 2000-01-11 | — | — | US | disclosed |
| EP-0597701-B1 | Conjugated enyne derivative and liquid crystal composition | CHISSO CORP (JP) | 1997-04-16 | — | — | EP | disclosed |
| EP-0761799-A1 | Liquid crystalline compound substituted with fluorine containing group, liquid crystal composition, and liquid crystal display device | Chisso Corporation (JP) | 1997-03-12 | — | — | EP | disclosed |
| US-5370819-A | Low viscosity | CHISSO CORPORATION (JP) | 1994-12-06 | — | — | US | disclosed |
| EP-0597701-A1 | Conjugated enyne derivative and liquid crystal composition | CHISSO CORPORATION (JP) | 1994-05-18 | — | — | EP | disclosed |