Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.37 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.37 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28032133 | 0.96 | CES2 (0.47) | CES2CES1CHRNB2CHRNA3CHRNA4 | |
| Hydrochloric Acid SCHEMBL28032649 | 0.96 | CES2 (0.47) | CES2CES1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL6140838 | 0.96 | — | — | |
| SCHEMBL289269 | 0.92 | CES2 (0.59) | CES2CES1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL9861947 | 0.89 | CES2 (0.65) | CES2CES1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL6141408 | 0.89 | CES2 (0.56) | CES2CES1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL993393 | 0.89 | CES2 (0.65) | CES2CES1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL6937404 | 0.89 | CES2 (0.65) | CES2CES1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL346017 | 0.89 | CES2 (0.65) | CES2CES1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL31486636 | 0.89 | CES2 (0.65) | CES2CES1CHRNB2CHRNA3CHRNA4 |
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 153 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119490397-A | Bicyclo [1.1.0] butanone compound and synthesis method thereof | 浙江工业大学 | 2025-02-21 | — | — | CN | claimed |
| CN-112690283-A | Herbicidal composition containing phenyl isoxazolines with optical activity and application | 沈阳中化农药化工研发有限公司 | 2021-04-23 | — | — | CN | claimed |
| CN-109879854-A | A kind of cyclobutane ketone compounds and preparation method thereof with antioxidation | 河南湾流生物科技有限公司 | 2019-06-14 | — | — | CN | claimed |
| CN-109075266-A | Charge-transporting semiconductor material and electronic device comprising same | 诺瓦尔德股份有限公司 | 2018-12-21 | — | — | CN | claimed |
| CN-104968345-B | 1, 5-naphthyridine derivatives and ME L K inhibitors containing 1, 5-naphthyridine derivatives | 肿瘤疗法科学股份有限公司 | 2018-05-08 | — | — | CN | claimed |
| CN-104892499-B | A kind of synthetic method of 2 pyridinone derivatives | 江西省科学院应用化学研究所 | 2017-07-21 | — | — | CN | claimed |
| CN-105143227-A | Substituted imidazo [1,2-B ] pyridazines as MKNK1 inhibitors | Bayer Pharma AG | 2015-12-09 | — | — | CN | claimed |
| CN-104968345-A | 1, 5-naphthyridine derivatives and MELK inhibitors containing 1, 5-naphthyridine derivatives | ONCOTHERAPY SCIENCE INC | 2015-10-07 | — | — | CN | claimed |
| CN-102532051-A | Mitotic kinesin inhibitors and methods of use thereof | ARRAY BIOPHARMA INC | 2012-07-04 | — | — | CN | claimed |
| CN-101679240-A | P1-non-epimerizable ketoamide inhibitors of HCV NS3 protease | SCHERING CORP | 2010-03-24 | — | — | CN | claimed |
| CN-101083988-A | Mitotic kinesin inhibitors and methods of use thereof | ARRAY BIOPHARMA INC (US) | 2007-12-05 | — | — | CN | claimed |
| US-20040244277-A1 | Strained ring compounds as combustion improvers for normally liquid fuels | LUBIZOL CORPORATION, THE | 2004-12-09 | — | — | US | claimed |
| EP-1425366-A2 | STRAINED RING COMPOUNDS AS COMBUSTION IMPROVERS FOR NORMALLY LIQUID FUELS | THE LUBRIZOL CORPORATION (US) | 2004-06-09 | — | — | EP | claimed |
| WO-2003020852-A2 | STRAINED RING COMPOUNDS AS COMBUSTION IMPROVERS FOR NORMALLY LIQUID FUELS | THE LUBRIZOL CORPORATION (US) | 2003-03-13 | — | — | WO | claimed |
| CN-119490397-A | Bicyclo [1.1.0] butanone compound and synthesis method thereof | 浙江工业大学 | 2025-02-21 | — | — | CN | disclosed |
| CN-116981669-B | Pyrimidine or pyrido heterocyclic adenosine receptor inhibitor, preparation method and application thereof | 上海齐鲁制药研究中心有限公司 | 2024-08-30 | — | — | CN | disclosed |
| EP-4276188-A1 | METHOD FOR SYNTHESIZING CHIRAL AMINE COMPOUND | Asymchem Laboratories (Tianjin) Co., Ltd. (CN) | 2023-11-15 | — | — | EP | disclosed |
| EP-0628033-A1 | BENZODIAZEPIN DERIVATIVES USEFUL AS CCK-RECEPTOR ANTAGONISTS | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1994-12-14 | — | — | EP | disclosed |
| WO-1993016999-A1 | BENZODIAZEPIN DERIVATIVES USEFUL AS CCK-RECEPTOR ANTAGONISTS | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1993-09-02 | — | — | WO | disclosed |
| CN-1075717-A | Benzodiazepine * derivatives | YAMANOUCHI PHARMA CO LTD (JP) | 1993-09-01 | — | — | CN | disclosed |