Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.65 |
| ▸ | CES1 | P23141 | 1/20 | 0.65 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 6/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | HSD11B2 | P80365 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9861947 | 1.00 | CES2 (0.65) | CES2CES1HDAC8HDAC6TSHR | |
| SCHEMBL28141435 | 1.00 | CES2 (0.65) | CES2CES1HDAC8HDAC6TSHR | |
| SCHEMBL27542869 | 1.00 | CES2 (0.65) | CES2CES1HDAC8HDAC6TSHR | |
| SCHEMBL9259378 | 1.00 | CES2 (0.65) | CES2CES1HDAC8HDAC6TSHR | |
| SCHEMBL346017 | 1.00 | CES2 (0.65) | CES2CES1HDAC8HDAC6TSHR | |
| SCHEMBL31486636 | 1.00 | CES2 (0.65) | CES2CES1HDAC8HDAC6TSHR | |
| SCHEMBL6937404 | 1.00 | CES2 (0.65) | CES2CES1HDAC8HDAC6TSHR | |
| SCHEMBL27502916 | 1.00 | CES2 (0.65) | CES2CES1HDAC8HDAC6TSHR | |
| SCHEMBL6140797 | 0.97 | CES2 (0.61) | CES2CES1HDAC8HDAC6TSHR | |
| SCHEMBL289269 | 0.96 | CES2 (0.59) | CES2CES1HDAC8HDAC6TSHR |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3387077-B1 | FORMULATIONS CONTAINING KETONES COMPRISING NON-AROMATIC CYCLES | MERCK PATENT GMBH (DE) | 2023-10-18 | — | — | EP | disclosed |
| EP-3552252-B1 | PREPARATION PROCESS FOR AN ELECTRONIC DEVICE | MERCK PATENT GMBH (DE) | 2023-05-17 | — | — | EP | disclosed |
| EP-3552252-B1 | PREPARATION PROCESS FOR AN ELECTRONIC DEVICE | MERCK PATENT GMBH (DE) | 2023-05-17 | — | — | EP | disclosed |
| US-11005042-B2 | Formulations containing ketones comprising non-aromatic cycles | MERCK PATENT GMBH (DE) | 2021-05-11 | — | — | US | disclosed |
| US-10892414-B2 | Process for making electronic device | MERCK PATENT GMBH (DE) | 2021-01-12 | — | — | US | disclosed |
| US-20200332321-A1 | ENGINEERED TRANSAMINASE POLYPEPTIDES AND USES THEREOF | Enzymaster (Ningbo) Bio-Engineering Co., Ltd (CN) | 2020-10-22 | — | — | US | disclosed |
| CN-106928033-B | Negative dielectric anisotropy liquid crystal compound, composition and application thereof | 北京八亿时空液晶科技股份有限公司 | 2020-09-29 | — | — | CN | disclosed |
| CN-107286953-B | Cyclopentyl negative dielectric anisotropy liquid crystal compound and composition and application thereof | 北京八亿时空液晶科技股份有限公司 | 2020-06-05 | — | — | CN | disclosed |
| US-20200066990-A1 | PREPARATION PROCESS FOR AN ELECTRONIC DEVICE | MERCK PATENT GMBH (DE) | 2020-02-27 | — | — | US | disclosed |
| EP-3552252-A1 | PREPARATION PROCESS FOR AN ELECTRONIC DEVICE | Merck Patent GmbH (DE) | 2019-10-16 | — | — | EP | disclosed |
| CN-106883861-B | A kind of liquid-crystal compounds, composition and its application | 北京八亿时空液晶科技股份有限公司 | 2019-04-19 | — | — | CN | disclosed |
| CN-107286950-A | A kind of cyclopenta liquid-crystal compounds, composition and its application | 北京八亿时空液晶科技股份有限公司 | 2017-10-24 | — | — | CN | disclosed |
| CN-107286953-A | A kind of cyclopenta class negative dielectric anisotropic liquid crystal compound and combinations thereof and application | 北京八亿时空液晶科技股份有限公司 | 2017-10-24 | — | — | CN | disclosed |
| CN-106928033-A | A kind of negative dielectric anisotropic liquid crystal compound, composition and its application | 北京八亿时空液晶科技股份有限公司 | 2017-07-07 | — | — | CN | disclosed |
| CN-106883861-A | A kind of liquid-crystal compounds, composition and its application | 北京八亿时空液晶科技股份有限公司 | 2017-06-23 | — | — | CN | disclosed |
| WO-2017097391-A1 | FORMULATIONS CONTAINING KETONES COMPRISING NON-AROMATIC CYCLES | MERCK PATENT GMBH (DE) | 2017-06-15 | — | — | WO | disclosed |
| EP-2268144-A2 | DIAMINOPYRIMIDINES AS PLANT PROTECTION AGENTS | Bayer CropScience AG (DE) | 2011-01-05 | — | — | EP | disclosed |
| WO-2009115267-A2 | DIAMINOPYRIMIDINES AS PLANT PROTECTION AGENTS | BAYER CROPSCIENCE AG (DE) | 2009-09-24 | — | — | WO | disclosed |
| US-6730788-B1 | COUPLING WITH KETONE IN PRESENCE OF LANTHANIDE II METAL COMPOUND | UNIVERSITY OF NOTRE DAME | 2004-05-04 | — | — | US | disclosed |
| US-3956316-A | PROGESTATIONAL AND SALT-RETAINING AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1976-05-11 | — | — | US | disclosed |