Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 6/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.37 |
| ▸ | PNMT | P11086 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12107538 | 0.81 | CYP3A4 (0.54) | IDO1CYP3A4ALDH1A1NPSR1KDM1A | |
| SCHEMBL1755262 | 0.79 | MAPT (0.49) | IDO1CYP3A4ALDH1A1NPSR1KDM1A | |
| SCHEMBL4026046 | 0.79 | CYP3A4 (0.48) | IDO1CYP3A4ALDH1A1NPSR1KDM1A | |
| SCHEMBL30031076 | 0.79 | CYP3A4 (0.48) | IDO1CYP3A4ALDH1A1NPSR1KDM1A | |
| SCHEMBL232137 | 0.78 | IDO1 (1.00) | IDO1ALDH1A1PNMT | |
| SCHEMBL5351507 | 0.78 | IDO1 (0.52) | IDO1CYP3A4ALDH1A1GAAMAPT | |
| SCHEMBL3763570 | 0.77 | CYP3A4 (0.46) | IDO1CYP3A4ALDH1A1NPSR1KDM1A | |
| SCHEMBL9073026 | 0.77 | CYP3A4 (0.46) | IDO1CYP3A4ALDH1A1NPSR1KDM1A | |
| SCHEMBL8368071 | 0.77 | CYP3A4 (0.46) | IDO1CYP3A4ALDH1A1NPSR1KDM1A | |
| SCHEMBL109221 | 0.77 | CYP3A4 (0.52) | CYP3A4ALDH1A1NPSR1KDM1APNMT |
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-117886723-A | Synthesis method of 2-chloro-4-methylsulfonyl benzoic acid | 辽宁龙田化工科技有限公司 | 2024-04-16 | — | — | CN | claimed |
| CN-117886723-A | Synthesis method of 2-chloro-4-methylsulfonyl benzoic acid | 辽宁龙田化工科技有限公司 | 2024-04-16 | — | — | CN | disclosed |
| US-4458079-A | BACTERICIDES, FUNGICIDES | BRISTOL-MYERS COMPANY (US) | 1984-07-03 | — | — | US | disclosed |