Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.57 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.57 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.57 |
| ▸ | SLC9A3 | P48764 | 1/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9772450 | 1.00 | SIGMAR1 (0.61) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL9492502 | 0.90 | SIGMAR1 (0.66) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL9704626 | 0.90 | SIGMAR1 (0.71) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL7962240 | 0.87 | SIGMAR1 (0.47) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL9772385 | 0.87 | SIGMAR1 (0.47) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL9813884 | 0.85 | SIGMAR1 (0.70) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL9749142 | 0.85 | SIGMAR1 (0.70) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL9813889 | 0.85 | SIGMAR1 (0.70) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| 1,2-Dichlorobenzene SCHEMBL9643933 | 0.83 | SIGMAR1 (0.54) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL7962880 | 0.82 | OPRK1 (0.82) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR |
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-6271395-B1 | E.G.,(.+-.)-N-(2,3-DIHYDRO-2-(1-PYRROLIDINYL)-1H-INDEN-1-Y1) -2 ,4-DINITRO-N-METHYL-BENZENE-ACETAMIDE; STRONG AFFINITY FOR OPTICAL RECEPTORS, CENTRAL ANALGESIC, DIURETIC, ANTIARRYTHMIC, HYPOTENSIVE AND ANTIISCHEMIC ACTIVITY. | HOECHST MARION ROUSSOL (FR) | 2001-08-07 | — | — | US | disclosed |
| EP-0258096-B1 | INDANE DERIVATIVES, PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THE INTERMEDIATES OBTAINED | ROUSSEL-UCLAF (FR) | 1992-09-09 | — | — | EP | disclosed |
| EP-0258096-A2 | Indane derivatives, process for their preparation, their use as medicines, pharmaceutical compositions containing them and the intermediates obtained | ROUSSEL-UCLAF (FR) | 1988-03-02 | — | — | EP | disclosed |