Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 2/20 | 0.47 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | DRD1 | P21728 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
| ▸ | CALM1 | P0DP23 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.46 |
| ▸ | STAT3 | P40763 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12124783 | 0.88 | HDAC1 (0.53) | KCNH2TMEM97SIGMAR1CALM1 | |
| SCHEMBL13250643 | 0.86 | KCNH2 (0.51) | KCNH2TMEM97SIGMAR1KDM4EATM | |
| SCHEMBL462591 | 0.86 | HDAC1 (0.52) | KCNH2TMEM97SIGMAR1KDM4EATM | |
| SCHEMBL30335458 | 0.84 | TNKS2 (0.54) | KCNH2TMEM97SIGMAR1KDM4EATM | |
| SCHEMBL22609987 | 0.84 | TNKS2 (0.54) | KCNH2TMEM97SIGMAR1KDM4EATM | |
| SCHEMBL9077595 | 0.83 | TTR (0.57) | KDM4EATMCALM1POLBHIF1A | |
| SCHEMBL29446268 | 0.83 | ATM (0.66) | KDM4EATMPOLBSTAT3CYP19A1 | |
| SCHEMBL13098004 | 0.83 | ATM (0.66) | KDM4EATMPOLBSTAT3CYP19A1 | |
| SCHEMBL296593 | 0.83 | ATM (0.66) | KDM4EATMPOLBSTAT3CYP19A1 | |
| SCHEMBL13098012 | 0.83 | ATM (0.66) | KDM4EATMPOLBSTAT3CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011061750-A3 | PROCESS FOR THE PREPARATION OF ILOPERIDONE USING A NOVEL INTERMEDIATE | SYMED LABS LIMITED (IN) | 2012-10-04 | — | — | WO | disclosed |
| WO-2012032532-A1 | \"PROCESSES FOR THE PREPARATION OF 4'-[3-[4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)PIPERIDINO]PROPOXY]-3'-METHOXYACETOPHENONE AND INTERMEDIATES THEREOF\ | SYMED LABS LIMITED (IN) | 2012-03-15 | — | — | WO | disclosed |
| WO-2011061750-A2 | PROCESS FOR THE PREPARATION OF ILOPERIDONE USING A NOVEL INTERMEDIATE | SYMED LABS LIMITED (IN) | 2011-05-26 | — | — | WO | disclosed |
| WO-2011061750-A2 | PROCESS FOR THE PREPARATION OF ILOPERIDONE USING A NOVEL INTERMEDIATE | SYMED LABS LIMITED (IN) | 2011-05-26 | — | — | WO | disclosed |