Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8635869 | 0.91 | CYP1A2 (0.37) | TLR4LMNAMAPT | |
| SCHEMBL8640047 | 0.90 | CYP1A2 (0.38) | TLR4CYP2C9ALDH1A1 | |
| SCHEMBL8635030 | 0.87 | TLR4 (0.31) | TLR4 | |
| SCHEMBL3351382 | 0.71 | NFKB1 (0.30) | — | |
| SCHEMBL1666552 | 0.69 | TLR4 (0.51) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL1666553 | 0.69 | TLR4 (0.51) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL8215701 | 0.69 | TLR4 (0.51) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL10985227 | 0.67 | CA1 (0.30) | — | |
| SCHEMBL10022182 | 0.67 | TLR4 (0.44) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL15203851 | 0.67 | TLR4 (0.44) | TLR4CYP2C9ALDH1A1LMNAMAPT |
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-0571652-B1 | Liquid crystalline substituted dihydrobenzene derivatives | CITIZEN WATCH CO LTD (JP) | 1998-08-05 | — | — | EP | disclosed |
| US-5342546-A | Liquid crystal compositions | L.C.C. CONSULTANTS CO., LTD. (JP) | 1994-08-30 | — | — | US | disclosed |
| EP-0571652-A1 | Liquid crystalline substituted dihydrobenzene derivatives | L.C.C. CONSULTANTS CO., LTD. (JP) | 1993-12-01 | — | — | EP | disclosed |