Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.48 |
| ▸ | MAOB | P27338 | 4/20 | 0.48 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | KLK7 | P49862 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | BCL2 | P10415 | 1/20 | 0.45 |
| ▸ | IL2 | P60568 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28590304 | 0.85 | PTPN1 (0.59) | MAOAMAOBRAB9ASMN1; SMN2KDM4E | |
| SCHEMBL28596598 | 0.85 | PTPN1 (0.46) | MAOAMAOBALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL28586119 | 0.80 | PTPN1 (0.42) | MAOAMAOBSMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL28586498 | 0.78 | PTPN1 (0.46) | MAOBKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL30367335 | 0.77 | PGR (0.46) | RAB9ASMN1; SMN2KDM4EALDH1A1MAPT | |
| SCHEMBL28988631 | 0.77 | PGR (0.46) | RAB9ASMN1; SMN2KDM4EALDH1A1MAPT | |
| SCHEMBL23135513 | 0.76 | PIN1 (0.54) | MAOAMAOBRAB9ASMN1; SMN2KDM4E | |
| SCHEMBL28172130 | 0.74 | RAB9A (0.67) | MAOAMAOBGSK3BRAB9AKLK7 | |
| SCHEMBL29640433 | 0.74 | RAB9A (0.67) | MAOAMAOBGSK3BRAB9AKLK7 | |
| SCHEMBL18878405 | 0.74 | PTPN1 (0.56) | MAOAMAOBSMN1; SMN2ALDH1A1MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115974825-B | Method for preparing 3-substituted chromanone by metal-free catalytic hydrogenation | 中国科学院化学研究所 | 2024-03-05 | — | — | CN | disclosed |
| 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 |