Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 8/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD5 | P21918 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10915804 | 0.84 | PTPN1 (0.44) | LMNATSHRKCNH2DRD1HTR1A | |
| SCHEMBL7682354 | 0.83 | DRD1 (0.50) | SMN1; SMN2LMNADRD1DRD2DRD4 | |
| SCHEMBL16399864 | 0.81 | DRD1 (0.33) | SMN1; SMN2CHRM2LMNATSHRCHRM1 | |
| SCHEMBL16178364 | 0.81 | SMN1; SMN2 (0.39) | SMN1; SMN2CHRM2LMNATSHRCHRM1 | |
| SCHEMBL3602910 | 0.80 | ALDH1A1 (0.50) | SMN1; SMN2LMNADRD1DRD2DRD4 | |
| SCHEMBL2376161 | 0.80 | LIPE (0.43) | SMN1; SMN2CHRM2LMNATSHRCHRM1 | |
| SCHEMBL18700982 | 0.78 | FABP3 (0.50) | TSHRALOX15KDM4EMAPTMAPK1 | |
| SCHEMBL17276070 | 0.77 | NPC1 (0.56) | SMN1; SMN2LMNAKDM4EMAPTMAPK1 | |
| SCHEMBL10458074 | 0.75 | LMNA (0.52) | SMN1; SMN2CHRM2LMNATSHRCHRM1 | |
| SCHEMBL1888309 | 0.74 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9365771-B2 | Liquid crystal compounds containing a difluoromethyleneoxy linking group that hydrogen substituted by deuterium, their preparation and application | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) | 2016-06-14 | — | — | US | disclosed |
| US-20140312276-A1 | LIQUID CRYSTAL COMPOUNDS CONTAINING A DIFLUOROMETHYLENEOXY LINKING GROUP THAT HYDROGEN SUBSTITUTED BY DEUTERIUM, THEIR PREPARATION AND APPLICATION | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) | 2014-10-23 | — | — | US | disclosed |