Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL9862067 | 0.71 | NPSR1 (0.38) | PDK2 | |
| SCHEMBL9861348 | 0.69 | PDK2 (0.35) | PDK2KCNQ2 | |
| SCHEMBL9861969 | 0.68 | PDK2 (0.46) | PDK2 | |
| SCHEMBL9861333 | 0.68 | KCNQ2 (0.42) | PDK2KCNQ2 | |
| SCHEMBL9861961 | 0.63 | KCNQ2 (0.40) | PDK2KCNQ2 | |
| SCHEMBL9861632 | 0.61 | S100A4 (0.38) | PDK2 | |
| SCHEMBL8816141 | 0.59 | PDK2 (0.48) | PDK2KCNQ2 | |
| SCHEMBL9861622 | 0.58 | PDK2 (0.76) | PDK2 | |
| SCHEMBL4870136 | 0.58 | IDO1 (0.38) | KCNQ2 | |
| SCHEMBL20151671 | 0.58 | IDO1 (0.38) | KCNQ2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5008425-A | Trifluoromethylation of carbonyl compounds | ETHYL CORPORATION (US) | 1991-04-16 | — | — | US | disclosed |
| US-4845258-A | Production of gem-disubstituted cyclohexadienones | ETHYL CORPORATION (US) | 1989-07-04 | — | — | US | disclosed |
| US-4804774-A | Production of gem-disubstituted cyclohexadienones | ETHYL CORPORATION (US) | 1989-02-14 | — | — | US | disclosed |
| US-4804773-A | Production of gem-disubstituted cyclohexadienones | ETHYL CORPORATION (US) | 1989-02-14 | — | — | US | disclosed |