SCHEMBL1160150

SCHEMBL1160150

COc1c(C)cnc(CCl)c1C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGXT P21549 1/20 0.64
HSP90AA1 P07900 9/20 0.48
TRAP1 Q12931 2/20 0.48
HSP90AB1 P08238 6/20 0.45
HSP90B1 P14625 1/20 0.45
PDE10A Q9Y233 1/20 0.43
KMT2A Q03164 4/20 0.42
WDR5 P61964 3/20 0.42
ATP4A P20648 2/20 0.42
ATP4B P51164 2/20 0.42
SHMT2 P34897 1/20 0.42
BRS3 P32247 2/20 0.41
DDAH1 O94760 2/20 0.41
ENGASE Q8NFI3 2/20 0.41
SARM1 Q6SZW1 1/20 0.41
IDO2 Q6ZQW0 1/20 0.41
CYP2C9 P11712 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ABCB11 O95342 1/20 0.40
ALDH1A1 P00352 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL29546790 1.00 AGXT (0.64) AGXTHSP90AA1TRAP1HSP90AB1HSP90B1
Hydrochloric Acid SCHEMBL29385728 0.98 AGXT (0.62) AGXTHSP90AA1TRAP1HSP90AB1HSP90B1
Hydrochloric Acid SCHEMBL311423 0.98 AGXT (0.62) AGXTHSP90AA1TRAP1HSP90AB1HSP90B1
SCHEMBL29892728 0.98 AGXT (0.62) AGXTHSP90AA1TRAP1HSP90AB1HSP90B1
Hydrochloric Acid SCHEMBL8063817 0.92 AGXT (0.55) AGXTHSP90AA1TRAP1HSP90AB1HSP90B1
SCHEMBL3801066 0.90 AGXT (0.53) AGXTHSP90AA1TRAP1HSP90AB1HSP90B1
SCHEMBL2629580 0.85 AGXT (0.46) AGXTHSP90AA1TRAP1HSP90AB1HSP90B1
SCHEMBL27278545 0.83 AGXT (0.45) AGXTHSP90AA1TRAP1HSP90AB1HSP90B1
SCHEMBL2629579 0.83 AGXT (0.49) AGXTHSP90AA1TRAP1HSP90AB1HSP90B1
Hydrochloric Acid SCHEMBL2111386 0.83 AGXT (0.45) AGXTHSP90AA1TRAP1HSP90AB1HSP90B1

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 283 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114184699-B Method for determining potential genotoxic impurities in esomeprazole sodium by liquid chromatography-mass spectrometry 北京悦康科创医药科技股份有限公司 2023-08-15 CN claimed
CN-114805193-B Preparation method of omeprazole intermediate 南京红太阳医药研究院有限公司 2023-06-20 CN claimed
CN-115785067-A Preparation method of impurity compound of esomeprazole thioether 北京京卫燕康药物研究所有限公司 2023-03-14 CN claimed
CN-112229920-B Method for detecting potential genotoxic impurities of esomeprazole sodium 海南中玉药业有限公司 2022-10-21 CN claimed
CN-110317164-B Preparation method of omeprazole intermediate 抚州三和医药化工有限公司 2022-08-19 CN claimed
CN-114805193-A Preparation method of omeprazole intermediate 南京红太阳医药研究院有限公司 2022-07-29 CN claimed
CN-110317164-A A kind of preparation method of intermediate of omeprazole 抚州三和医药化工有限公司 2019-10-11 CN claimed
CN-104803978-B A kind of preparation method of esomeprazole magnesium 艾美科健(中国)生物医药有限公司 2019-06-18 CN claimed
CN-103936715-B The process for purification of a kind of Esomeprazole sodium and synthetic method 哈尔滨珍宝制药有限公司 2016-08-24 CN claimed
CN-103694223-B A kind of one kettle way prepares the method for esomeprazole magnesium 乐普药业股份有限公司 2016-08-10 CN claimed
US-7227024-B2 Method for the synthesis of a benzimidazole compound ASTRAZENECA AB (SE) 2007-06-05 US claimed
US-20060084811-A1 Method for the synthesis of a benzimidazole compound ASTRAZENECA AB (SE) 2006-04-20 US claimed
EP-1556370-A1 METHOD FOR THE SYNTHESIS OF A BENZIMIDAZOLE COMPOUND AstraZeneca AB (SE) 2005-07-27 EP claimed
WO-2004035565-A1 METHOD FOR THE SYNTHESIS OF A BENZIMIDAZOLE COMPOUND ASTRAZENECA AB (SE) 2004-04-29 WO claimed
WO-2000027841-A1 METHOD OF PREPARING SULFIDE DERIVATIVES DONG-A PHARMACEUTICAL CO., LTD. (KR) 2000-05-18 WO claimed
EP-0868423-A1 METHOD FOR THE SYNTHESIS OF A BENZIMIDAZOLE COMPOUND Astra Aktiebolag (SE) 1998-10-07 EP claimed
WO-1997022603-A1 METHOD FOR THE SYNTHESIS OF A BENZIMIDAZOLE COMPOUND ASTRA AKTIEBOLAG (SE) 1997-06-26 WO claimed
EP-0369208-B1 PROCESS FOR THE PREPARATION OF 3,5-DIMETHYL-4-METHOXY PYRIDINE DERIVATIVES, AND INTERMEDIATE THEREFOR Hafslund Nycomed Pharma Aktiengesellschaft (AT) 1993-03-17 EP claimed
EP-0240158-B1 BENZIMIDAZOLE DERIVATIVES TOKYO TANABE COMPANY LIMITED (JP) 1991-04-03 EP claimed
EP-0369208-A1 Process for the preparation of 3,5-dimethyl-4-methoxy pyridine derivatives, and intermediate therefor Hafslund Nycomed Pharma Aktiengesellschaft (AT) 1990-05-23 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060084811-A1 Method for the synthesis of a benzimidazole compound CYP2E1, CYP3A4, CYP3A7 AGXT 2450/4885HSP90AA1 2906/4885TRAP1 4155/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.