Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | FLT3 | P36888 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28874637 | 1.00 | BACE1 (0.41) | BACE1HTTCYP1A2CYP2C19PLAU | |
| SCHEMBL28874631 | 0.88 | CYP1A2 (0.39) | BACE1HTTCYP1A2CYP2C19PLAU | |
| SCHEMBL29966792 | 0.79 | CYP1A2 (0.43) | BACE1CYP1A2CYP2A6NPC1RAB9A | |
| SCHEMBL28874626 | 0.79 | CYP1A2 (0.43) | BACE1CYP1A2CYP2A6NPC1RAB9A | |
| SCHEMBL9190130 | 0.79 | TYMS (0.40) | HTTCYP2A6MEN1KMT2ANPC1 | |
| SCHEMBL9197572 | 0.76 | CYP1A2 (0.41) | HTTCYP1A2CYP2A6MEN1KMT2A | |
| SCHEMBL29966580 | 0.76 | BACE1 (0.45) | BACE1CYP1A2CYP2C19EGFR | |
| SCHEMBL9196002 | 0.76 | BACE1 (0.45) | BACE1CYP1A2CYP2C19EGFR | |
| SCHEMBL9196310 | 0.76 | NR1I2 (0.38) | MEN1KMT2AALDH1A1CHEK1FLT3 | |
| SCHEMBL30894672 | 0.76 | NCF1 (0.45) | CYP1A2CYP2C19CYP2A6MEN1KMT2A |
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-115260122-B | Naphthothiazole derivative and synthesis method thereof | 陕西科技大学 | 2024-05-28 | — | — | CN | disclosed |
| CN-115260122-A | Naphthothiazole derivative and synthesis method thereof | 陕西科技大学 | 2022-11-01 | — | — | CN | disclosed |