Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | ESR1 | P03372 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.50 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.49 |
| ▸ | NAAA | Q02083 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14722275 | 0.87 | TSHR (0.54) | TSHRALDH1A1LMNACYP1A2CYP2C19 | |
| SCHEMBL14722604 | 0.87 | TSHR (0.54) | TSHRALDH1A1LMNACYP1A2CYP2C19 | |
| SCHEMBL6578044 | 0.85 | TDP1 (0.64) | TSHRALDH1A1LMNACYP1A2CYP2C19 | |
| SCHEMBL14984030 | 0.84 | TDP1 (0.62) | TSHRALDH1A1LMNACYP1A2CYP2C19 | |
| SCHEMBL6578053 | 0.84 | TDP1 (0.62) | TSHRALDH1A1LMNACYP1A2CYP2C19 | |
| SCHEMBL10973582 | 0.82 | ALDH1A1 (0.71) | TSHRALDH1A1LMNACYP1A2CYP2C19 | |
| SCHEMBL12865768 | 0.82 | TSHR (0.58) | HTTTSHRALDH1A1LMNACYP1A2 | |
| SCHEMBL13410610 | 0.82 | TSHR (0.59) | TSHRALDH1A1LMNACYP1A2CYP2C19 | |
| SCHEMBL29191674 | 0.81 | ESR1 (0.61) | TSHRALDH1A1LMNACYP1A2CYP2C19 | |
| SCHEMBL14924318 | 0.81 | ALDH1A1 (0.69) | TSHRALDH1A1LMNACYP1A2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4400529-A1 | SEMI-AROMATIC POLYETHER ESTER, PREPARATION METHOD THEREFOR AND USE THEREOF | Zhuhai Wango Chemical Co., Ltd. (CN) | 2024-07-17 | — | — | EP | disclosed |