Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | FAAH | O00519 | 4/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | GPR88 | Q9GZN0 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL224692 | 0.83 | ALOX15 (0.46) | TSHRFAAHTDP1CHRM1AKR1A1 | |
| SCHEMBL8761678 | 0.82 | TSHR (0.44) | TSHRFAAHTDP1CHRM1AKR1A1 | |
| SCHEMBL30889161 | 0.82 | — | — | |
| SCHEMBL28515824 | 0.80 | TSHR (0.42) | TSHRFAAHTDP1CHRM1AKR1A1 | |
| SCHEMBL4442772 | 0.80 | TSHR (0.42) | TSHRFAAHTDP1CHRM1AKR1A1 | |
| SCHEMBL4442774 | 0.80 | TSHR (0.42) | TSHRFAAHTDP1CHRM1AKR1A1 | |
| SCHEMBL1985053 | 0.80 | ALDH1A1 (0.44) | TSHRFAAHTDP1CHRM1AKR1A1 | |
| SCHEMBL9435730 | 0.78 | TSHR (0.41) | TSHRFAAHTDP1CHRM1AKR1A1 | |
| SCHEMBL14245323 | 0.78 | SOAT1 (0.46) | TSHRFAAHTDP1CHRM1AKR1A1 | |
| SCHEMBL224691 | 0.78 | TSHR (0.41) | TSHRFAAHTDP1CHRM1AKR1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024094637-A1 | PROCESS FOR THE PREPARATION OF CYCLIC KETONES | ARXADA AG (CH) | 2024-05-10 | — | — | WO | disclosed |