Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.50 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.50 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23956066 | 0.88 | KCNH2 (0.44) | KCNH2CYP1A1CYP1A2CYP1B1APP | |
| SCHEMBL21387115 | 0.88 | KCNH2 (0.47) | KCNH2CYP1A1CYP1A2CYP1B1APP | |
| SCHEMBL5134940 | 0.87 | APP (0.57) | KCNH2CYP1A2APPGRM5MAPT | |
| SCHEMBL18674201 | 0.85 | CYP1A1 (0.47) | KCNH2CYP1A1CYP1A2CYP1B1APP | |
| SCHEMBL24538167 | 0.82 | KCNH2 (0.45) | KCNH2CYP1A1CYP1A2CYP1B1APP | |
| SCHEMBL19935634 | 0.81 | KCNH2 (0.47) | KCNH2CYP1A1CYP1A2CYP1B1APP | |
| SCHEMBL15014376 | 0.79 | CYP1A2 (0.46) | KCNH2CYP1A1CYP1A2CYP1B1GRM5 | |
| SCHEMBL19682717 | 0.78 | ALDH1A1 (0.35) | KCNH2CYP1A1CYP1A2CYP1B1MAPT | |
| SCHEMBL5886608 | 0.78 | APP (0.71) | KCNH2CYP1A1CYP1A2CYP1B1APP | |
| SCHEMBL17104750 | 0.78 | APP (0.58) | CYP1A2APPMAPTMEN1KMT2A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3670503-B1 | COMPOUND, LIQUID CRYSTAL MEDIUM CONTAINING SAME, AND USE THEREOF | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO LTD (CN) | 2023-10-18 | — | — | EP | disclosed |
| EP-3433236-B1 | CYANOPYRIMIDINE DERIVATIVES SUITABLE AS COMPONENTS IN LIQUID CRYSTAL MEDIA | MERCK PATENT GMBH (DE) | 2021-10-27 | — | — | EP | disclosed |
| WO-2021116080-A1 | AROMATIC ISOTHIOCYANATES | MERCK PATENT GMBH (DE) | 2021-06-17 | — | — | WO | disclosed |
| EP-3670503-A1 | COMPOUND, LIQUID CRYSTAL MEDIUM CONTAINING SAME, AND USE THEREOF | Shijiazhuang Chengzhi Yonghua Display Material Co., Ltd. (CN) | 2020-06-24 | — | — | EP | disclosed |
| EP-3504293-B1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2020-05-13 | — | — | EP | disclosed |
| WO-2017162707-A1 | CYANOPYRIMIDINE DERIVATIVES SUITABLE AS COMPONENTS IN LIQUID CRYSTAL MEDIA | MERCK PATENT GMBH (DE) | 2017-09-28 | — | — | WO | disclosed |
| EP-1191082-A1 | Liquid cristalline mixtures | MERCK PATENT GmbH (DE) | 2002-03-27 | — | — | EP | disclosed |