Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MYC | P01106 | 1/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | F11 | P03951 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 2/20 | 0.44 |
| ▸ | PPARA | Q07869 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3388103 | 1.00 | TSHR (0.53) | TSHRGAAALDH1A1TP53CA1 | |
| SCHEMBL30843194 | 0.86 | TSHR (0.52) | TSHRGAAALDH1A1TP53CA1 | |
| SCHEMBL12505436 | 0.85 | ALDH1A1 (0.46) | TSHRGAAALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL17282266 | 0.85 | KMT2A (0.50) | TSHRALDH1A1SMN1; SMN2L3MBTL1POLB | |
| SCHEMBL17282253 | 0.84 | MAPT (0.44) | TSHRGAAALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL17040592 | 0.83 | TSHR (0.53) | TSHRGAAALDH1A1TP53CA1 | |
| SCHEMBL14692447 | 0.82 | TSHR (0.46) | TSHRGAAALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL30843241 | 0.82 | ABL1 (0.51) | ALDH1A1SMN1; SMN2POLBMEN1MAPT | |
| SCHEMBL26966944 | 0.82 | ABL1 (0.51) | ALDH1A1SMN1; SMN2POLBMEN1MAPT | |
| SCHEMBL27699137 | 0.82 | ALDH1A1 (0.59) | TSHRGAAALDH1A1TP53CA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120136858-A | Compounds useful as ALCAT1 inhibitors | 中美博瑞纳制药有限公司 | 2025-06-13 | — | — | CN | disclosed |
| CN-110709394-B | Compounds useful as ALCAT1 inhibitors | 中美博瑞纳制药有限公司 | 2025-02-21 | — | — | CN | disclosed |
| CN-114206856-A | Anti-malarial hexahydropyrimidine analogues | UCB生物制药有限责任公司 | 2022-03-18 | — | — | CN | disclosed |