Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.30 |
| ▸ | RELA | Q04206 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21408683 | 1.00 | TLR4 (0.35) | TLR4TSHRCYP1A2MEN1ALDH1A1 | |
| SCHEMBL21408492 | 1.00 | TLR4 (0.35) | TLR4TSHRCYP1A2MEN1ALDH1A1 | |
| SCHEMBL21408664 | 0.96 | CYP1A2 (0.35) | TLR4TSHRCYP1A2MEN1ALDH1A1 | |
| SCHEMBL21432069 | 0.96 | CYP1A2 (0.35) | TLR4TSHRCYP1A2MEN1ALDH1A1 | |
| SCHEMBL23151644 | 0.94 | TSHR (0.37) | TLR4TSHRCYP1A2MEN1ALDH1A1 | |
| SCHEMBL21408653 | 0.94 | TSHR (0.37) | TLR4TSHRCYP1A2MEN1ALDH1A1 | |
| SCHEMBL21408495 | 0.91 | MEN1 (0.34) | MEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL21408650 | 0.91 | MEN1 (0.34) | MEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL9054098 | 0.79 | ALDH1A1 (0.46) | TLR4MEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL21408667 | 0.78 | MAPT (0.43) | TLR4TSHRMEN1ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-4153552-A2 | PROCESS AND INTERMEDIATES FOR PREPARING 3-(CYCLOHEX-1-EN-1-YL) PROPANAL DERIVATIVES | Firmenich SA (CH) | 2023-03-29 | — | — | EP | disclosed |
| WO-2022049036-A2 | PROCESS FOR PREPARING 3-(CYCLOHEX-1-EN-1-YL)PROPANAL DERIVATIVES | FIRMENICH SA (CH) | 2022-03-10 | — | — | WO | disclosed |