Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 4/20 | 0.37 |
| ▸ | PIM3 | Q86V86 | 4/20 | 0.37 |
| ▸ | PIM2 | Q9P1W9 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | MC4R | P32245 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL15533224 | 0.83 | ALDH1A1 (0.45) | PIM1PIM3PIM2LMNAMC4R | |
| SCHEMBL2659195 | 0.77 | ADRB1 (0.56) | PIM1PIM3PIM2LMNAHTR1A | |
| SCHEMBL28994707 | 0.75 | LMNA (0.44) | PIM1PIM3PIM2LMNAMEN1 | |
| SCHEMBL28557480 | 0.75 | MEN1 (0.34) | PIM1PIM3PIM2LMNAMEN1 | |
| SCHEMBL28572115 | 0.75 | MEN1 (0.34) | LMNAMEN1THRBBLMKMT2A | |
| SCHEMBL31051821 | 0.74 | ADRB1 (0.63) | LMNAHTR1AADRB1ALDH1A1 | |
| SCHEMBL15057516 | 0.74 | PIM1 (0.37) | PIM1PIM3PIM2LMNAMEN1 | |
| SCHEMBL4423739 | 0.74 | ADRB1 (0.52) | LMNAHTR1AADRB1ALDH1A1NOTUM | |
| SCHEMBL27994093 | 0.73 | ALDH1A1 (0.36) | PIM1PIM3PIM2LMNAMEN1 | |
| SCHEMBL31052152 | 0.72 | ADRB1 (0.43) | LMNAHTR1AADRB1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112812781-B | Liquid crystal compound based on bipiperazine benzoxazole and preparation method thereof | 西安瑞联新材料股份有限公司 | 2023-09-29 | — | — | CN | disclosed |
| CN-112812781-A | Bipiperazine benzoxazole-based liquid crystal compound and preparation method thereof | 西安瑞联新材料股份有限公司 | 2021-05-18 | — | — | CN | disclosed |