Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGKA | P23743 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | PRKCA | P17252 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | PAM | P19021 | 2/20 | 0.37 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5109822 | 0.85 | CYP1A2 (0.44) | CYP1A2TSHRKDM4E | |
| SCHEMBL10972586 | 0.84 | PRKCA (0.40) | DGKAPRKCATSHRNAAAKDM4E | |
| SCHEMBL1863674 | 0.81 | CYP1A2 (0.47) | CYP1A2TSHRKDM4E | |
| SCHEMBL3879820 | 0.80 | AKR1B1 (0.47) | TSHR | |
| SCHEMBL28226355 | 0.80 | TSHR (0.55) | DGKAPRKCATSHRNAAA | |
| SCHEMBL16940322 | 0.79 | NAAA (0.47) | DGKAPRKCATSHRNAAA | |
| SCHEMBL5103655 | 0.79 | CYP1A2 (0.39) | CYP1A2TSHR | |
| SCHEMBL16248383 | 0.79 | CYP1A2 (0.39) | CYP1A2TSHRKDM4E | |
| Cyclohexane SCHEMBL28326645 | 0.77 | DGKA (0.63) | DGKACYP1A2PRKCATSHRPAM | |
| SCHEMBL5712582 | 0.77 | TSHR (0.35) | CYP1A2TSHR |
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-0568040-B1 | Cyclohexane derivative and liquid crystal composition containing the same | CHISSO CORP (JP) | 1996-12-04 | — | — | EP | disclosed |
| US-5468421-A | Cyclohexane derivative and liquid crystal composition containing the same | CHISSO CORPORATION (JP) | 1995-11-21 | — | — | US | disclosed |
| EP-0568040-A1 | Cyclohexane derivative and liquid crystal composition containing the same | CHISSO CORPORATION (JP) | 1993-11-03 | — | — | EP | disclosed |