Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.45 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.45 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7999137 | 1.00 | SMN1; SMN2 (0.51) | SMN1; SMN2CHRNA1CHRNA3CHRNA7ALDH1A1 | |
| SCHEMBL7999133 | 1.00 | SMN1; SMN2 (0.51) | SMN1; SMN2CHRNA1CHRNA3CHRNA7ALDH1A1 | |
| SCHEMBL11710973 | 0.90 | CHRNA1 (0.52) | SMN1; SMN2CHRNA1CHRNA3CHRNA7ALDH1A1 | |
| SCHEMBL11811499 | 0.90 | CHRNA1 (0.52) | SMN1; SMN2CHRNA1CHRNA3CHRNA7ALDH1A1 | |
| SCHEMBL11708466 | 0.89 | CHRNA1 (0.48) | SMN1; SMN2CHRNA1CHRNA3CHRNA7ALDH1A1 | |
| SCHEMBL11805897 | 0.89 | CHRNA1 (0.48) | SMN1; SMN2CHRNA1CHRNA3CHRNA7ALDH1A1 | |
| SCHEMBL11810271 | 0.85 | SMN1; SMN2 (0.52) | SMN1; SMN2CHRNA1CHRNA3CHRNA7ALDH1A1 | |
| SCHEMBL11709538 | 0.85 | SMN1; SMN2 (0.52) | SMN1; SMN2CHRNA1CHRNA3CHRNA7ALDH1A1 | |
| SCHEMBL11811450 | 0.84 | SMN1; SMN2 (0.55) | SMN1; SMN2CHRNA1CHRNA3CHRNA7ALDH1A1 | |
| SCHEMBL11812512 | 0.84 | SMN1; SMN2 (0.55) | SMN1; SMN2CHRNA1CHRNA3CHRNA7ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4029791-A | INSECTICIDES | SHELL OIL COMPANY (US) | 1977-06-14 | — | — | US | disclosed |
| US-4002765-A | 2-(Nitromethylene)-1,3-diazacycloalkane insect control agents | SHELL OIL COMPANY (US) | 1977-01-11 | — | — | US | disclosed |
| US-3971774-A | INSECTICIDE | SHELL OIL COMPANY (US) | 1976-07-27 | — | — | US | disclosed |
| US-3969354-A | INSECTICIDE | SHELL OIL COMPANY (US) | 1976-07-13 | — | — | US | disclosed |
| US-3948934-A | 2-(Nitromethylene)-1,3-diazacycloalkane insect control agents | SHELL OIL COMPANY (US) | 1976-04-06 | — | — | US | disclosed |