Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 4/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | HTR1A | P08908 | 2/20 | 0.54 |
| ▸ | HTR7 | P34969 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | FAAH | O00519 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29078398 | 0.88 | ALDH1A1 (0.62) | HTR1AHTR7ACHEALDH1A1POLB | |
| SCHEMBL29078385 | 0.82 | L3MBTL1 (0.67) | SMN1; SMN2KMT2ALMNAMAPTACHE | |
| SCHEMBL13621137 | 0.81 | ALDH1A1 (0.57) | SMN1; SMN2MAPTNPSR1ALDH1A1POLB | |
| SCHEMBL30585263 | 0.80 | SIGMAR1 (0.50) | SMN1; SMN2MEN1KMT2ALMNAHTR1A | |
| SCHEMBL26101473 | 0.80 | RAB9A (0.58) | SMN1; SMN2KMT2AFAAHALDH1A1 | |
| SCHEMBL29078428 | 0.78 | CYP1A2 (0.57) | SMN1; SMN2KMT2ALMNAMAPTCYP1A2 | |
| SCHEMBL30585257 | 0.78 | CYP1A2 (0.57) | SMN1; SMN2KMT2ALMNAMAPTCYP1A2 | |
| SCHEMBL29078401 | 0.77 | ALDH1A1 (0.75) | SMN1; SMN2CYP1A2CYP2C19NPSR1ALDH1A1 | |
| SCHEMBL30585244 | 0.77 | HTR7 (0.73) | SMN1; SMN2KMT2AHTR1AHTR7ACHE | |
| SCHEMBL3837995 | 0.76 | MAPK1 (0.58) | SMN1; SMN2NPSR1ALDH1A1POLB |
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-116803981-A | Piperazine-containing amide or sulfonamide anti-inflammatory compound and preparation method and application thereof | 温州医科大学 | 2023-09-26 | — | — | CN | claimed |
| CN-116803981-A | Piperazine-containing amide or sulfonamide anti-inflammatory compound and preparation method and application thereof | 温州医科大学 | 2023-09-26 | — | — | CN | disclosed |