Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18878405 | 0.87 | PTPN1 (0.56) | MAPTALDH1A1PTPN1HTTGAA | |
| SCHEMBL28600756 | 0.82 | MAPT (0.45) | MAPTALDH1A1PTPN1HTTKDM4E | |
| SCHEMBL25442218 | 0.81 | CYP11B1 (0.48) | MAPTALDH1A1PKMPTPN1HTT | |
| SCHEMBL28988626 | 0.78 | ALDH1A1 (0.36) | MAPTALDH1A1PKMPTPN1HTT | |
| SCHEMBL28988609 | 0.77 | PTPN1 (0.59) | MAPTALDH1A1PKMPTPN1HTT | |
| SCHEMBL11974293 | 0.76 | MAOB (0.51) | MAPTALDH1A1PTPN1KDM4EHPGD | |
| SCHEMBL28990341 | 0.75 | ALDH1A1 (0.47) | MAPTALDH1A1PKMPTPN1HTT | |
| SCHEMBL28477936 | 0.75 | ALDH1A1 (0.47) | MAPTALDH1A1PKMPTPN1HTT | |
| SCHEMBL19182133 | 0.72 | PTPN1 (0.77) | MAPTALDH1A1PKMPTPN1HTT | |
| SCHEMBL29529294 | 0.72 | PTPN1 (0.77) | MAPTALDH1A1PKMPTPN1HTT |
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-115974825-A | Method for preparing 3-substituted chromanone through metal-free catalytic hydrogenation | 中国科学院化学研究所 | 2023-04-18 | — | — | CN | disclosed |
| CN-112898259-B | Method for preparing 3-substituted chromanone through nonmetal catalytic hydrogenation | 中国科学院化学研究所 | 2022-05-17 | — | — | CN | disclosed |
| CN-112898259-A | Method for preparing 3-substituted chromanone through nonmetal catalytic hydrogenation | 中国科学院化学研究所 | 2021-06-04 | — | — | CN | disclosed |