Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | NPC1 | O15118 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.47 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | TP53 | P04637 | 5/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | KDM6B | O15054 | 1/20 | 0.46 |
| ▸ | KDM6A | O15550 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29272684 | 1.00 | TOP2A (0.50) | TOP2AALDH1A1NPC1KDM4EHPGD | |
| SCHEMBL29504749 | 0.78 | TOP2A (0.62) | TOP2AALDH1A1NPC1KDM4EHPGD | |
| SCHEMBL171055 | 0.78 | TOP2A (0.62) | TOP2AALDH1A1NPC1KDM4EHPGD | |
| SCHEMBL12854009 | 0.76 | TOP2A (0.60) | TOP2AALDH1A1NPC1KDM4EHPGD | |
| SCHEMBL2865414 | 0.75 | TOP2A (0.49) | TOP2AALDH1A1NPC1KDM4EHPGD | |
| SCHEMBL824375 | 0.74 | NPC1 (0.69) | TOP2AALDH1A1NPC1KDM4EHPGD | |
| SCHEMBL29531707 | 0.74 | NPC1 (0.69) | TOP2AALDH1A1NPC1KDM4EHPGD | |
| SCHEMBL12794310 | 0.74 | MAPT (0.59) | TOP2AALDH1A1NPC1KDM4EHPGD | |
| SCHEMBL15976158 | 0.74 | TOP2A (0.58) | TOP2AALDH1A1NPC1KDM4EHPGD | |
| SCHEMBL1223141 | 0.74 | TOP2A (0.82) | TOP2AALDH1A1NPC1KDM4EHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118164976-A | 2- (7-Benzothiazolyl) benzo heterocycle compound and application thereof | 沈阳中化农药化工研发有限公司 | 2024-06-11 | — | — | CN | claimed |
| CN-118164976-A | 2- (7-Benzothiazolyl) benzo heterocycle compound and application thereof | 沈阳中化农药化工研发有限公司 | 2024-06-11 | — | — | CN | disclosed |