Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A13 | Q16696 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | GLA | P06280 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | CASP1 | P29466 | 3/20 | 0.39 |
| ▸ | CASP7 | P55210 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22946201 | 0.81 | HCRTR1 (0.57) | CYP2A13KDM4EALDH1A1GAAHSD17B10 | |
| SCHEMBL6481163 | 0.78 | POLB (0.33) | POLB | |
| SCHEMBL6482302 | 0.78 | MAPK1 (0.33) | KDM4EALDH1A1HSD17B10POLBLMNA | |
| SCHEMBL28542686 | 0.78 | FAAH (0.34) | ALDH1A1L3MBTL1KMT2A | |
| SCHEMBL6324155 | 0.78 | BUB1 (0.32) | MAPT | |
| SCHEMBL6479768 | 0.77 | P2RX7 (0.33) | HPGDMAPT | |
| SCHEMBL6482084 | 0.77 | ENPP2 (0.34) | RAB9ANPC1 | |
| SCHEMBL6603271 | 0.76 | MAPT (0.32) | HPGDMAPTRAB9AKMT2A | |
| SCHEMBL6331565 | 0.75 | BUB1 (0.31) | — | |
| SCHEMBL22946195 | 0.75 | CYP2A13 (0.58) | CYP2A13ALDH1A1HPGDL3MBTL1HTT |
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-112300092-B | Heterocyclylalkyl-substituted dichlorobenzoyl compounds and application thereof | 东莞市东阳光农药研发有限公司 | 2023-06-09 | — | — | CN | disclosed |
| WO-2021018135-A1 | HETEROCYCLYL ALKYL SUBSTITUTED DICHLOROBENZOYL COMPOUNDS AND APPLICATIONS THEREOF | 东莞市东阳光农药研发有限公司 | 2021-02-04 | — | — | WO | disclosed |
| CN-112300092-A | Heterocyclic alkyl substituted dichlorobenzoyl compound and application thereof | 东莞市东阳光农药研发有限公司 | 2021-02-02 | — | — | CN | disclosed |