Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11812798 | 0.89 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL11706544 | 0.80 | SMN1; SMN2 (0.33) | ALDH1A1 | |
| SCHEMBL11706978 | 0.70 | ABCB11 (0.32) | — | |
| SCHEMBL14626599 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL5054624 | 0.63 | ADRA2A (0.33) | — | |
| SCHEMBL11807112 | 0.60 | KCNN4 (0.38) | ALDH1A1TSHR | |
| SCHEMBL13784748 | 0.59 | — | — | |
| SCHEMBL11866308 | 0.58 | NOS3 (0.35) | TSHR | |
| Hydrochloric Acid SCHEMBL1305896 | 0.54 | — | — | |
| SCHEMBL1304629 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| 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 |