Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | F10 | P00742 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 5/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28655711 | 0.86 | GAA (0.62) | PTGS2SMN1; SMN2RAB9ANPC1ALDH1A1 | |
| SCHEMBL7821761 | 0.83 | ALDH1A1 (0.71) | PTGS2ALDH1A1MAOAGAAMEN1 | |
| SCHEMBL8060238 | 0.83 | NPC1 (0.75) | SMN1; SMN2F10RAB9ANPC1ALDH1A1 | |
| SCHEMBL28669917 | 0.83 | ALDH1A1 (0.70) | SMN1; SMN2F10RAB9ANPC1ALDH1A1 | |
| SCHEMBL28659193 | 0.79 | ALDH1A1 (0.71) | SMN1; SMN2RAB9ANPC1ALDH1A1GAA | |
| SCHEMBL6898441 | 0.76 | PTGS2 (1.00) | PTGS2SMN1; SMN2RAB9ANPC1ALDH1A1 | |
| SCHEMBL30825401 | 0.75 | ALDH1A1 (0.67) | SMN1; SMN2RAB9ANPC1ALDH1A1GAA | |
| SCHEMBL3132601 | 0.74 | AKR1C3 (0.65) | RAB9ANPC1ALDH1A1KMT2AMAPT | |
| SCHEMBL11783307 | 0.73 | PTGS2 (0.86) | PTGS2SMN1; SMN2RAB9ANPC1ALDH1A1 | |
| SCHEMBL29473289 | 0.71 | ALDH1A1 (0.71) | SMN1; SMN2RAB9ANPC1ALDH1A1GAA |
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-113698407-B | Method for preparing indazole [3,2-b ] quinazolin-7 (5H) -one derivative based on Ullmann coupling reaction | 武汉科技大学 | 2022-11-29 | — | — | CN | disclosed |
| CN-113698407-A | Method for preparing indazole [3,2-b ] quinazolin-7 (5H) -one derivative based on Ullmann coupling reaction | 武汉科技大学 | 2021-11-26 | — | — | CN | disclosed |