SCHEMBL2853219

SCHEMBL2853219

O=[C]CNC12CC3CC(CC(O)(C3)C1)C2

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 9/20 0.50
DPP8 Q6V1X1 4/20 0.46
DPP9 Q86TI2 3/20 0.46
FAP Q12884 1/20 0.46
ALDH1A1 P00352 1/20 0.40
PKM P14618 1/20 0.39
DPP7 Q9UHL4 1/20 0.38
EPHX2 P34913 1/20 0.38
GLMN Q92990 1/20 0.38

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
SCHEMBL28146962 1.00 DPP4 (0.50) DPP4DPP8DPP9FAPALDH1A1
SCHEMBL17048409 0.83 DPP4 (0.53) DPP4DPP8DPP9FAPALDH1A1
SCHEMBL15114218 0.80 GRIN2D (0.47) DPP4DPP8DPP9FAPALDH1A1
SCHEMBL7415894 0.79 GRIN2D (0.46) DPP4EPHX2
SCHEMBL12735378 0.78 DPP4 (0.56) DPP4DPP8DPP9FAPALDH1A1
SCHEMBL160300 0.77 DPP4 (0.58) DPP4DPP8DPP9FAPALDH1A1
SCHEMBL19160132 0.77 DPP4 (0.45) DPP4DPP8DPP9FAPALDH1A1
SCHEMBL27631871 0.76 DPP4 (0.47) DPP4DPP8DPP9FAPALDH1A1
SCHEMBL12354573 0.76 DPP4 (0.53) DPP4DPP8DPP9FAPALDH1A1
SCHEMBL13444794 0.74 GRIN2D (0.56) DPP4DPP8DPP9FAPALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110092738-A The preparation method of vildagliptin 深圳市第二人民医院 2019-08-06 CN disclosed
CN-105287604-B Pharmaceutical composition containing ibat inhibitor and bile acid binding agent 阿尔比里奥公司 2019-07-09 CN disclosed
CN-109111386-A The synthetic method of L- prolineamide 南京红杉生物科技有限公司 2019-01-01 CN disclosed
CN-108452311-A Composition for enhancing energetic supersession and method 纽斯尔特科学公司 2018-08-28 CN disclosed
CN-108295058-A Composition for enhancing energetic supersession and method 纽斯尔特科学公司 2018-07-20 CN disclosed
CN-104918610-B compositions and methods for enhancing energy metabolism 纽斯尔特科学公司 2018-04-10 CN disclosed
CN-104672243-B The preparation method of vildagliptin degradation impurity 华润赛科药业有限责任公司 2017-09-22 CN disclosed
CN-104557943-B Preparation method of vildagliptin impurities 扬子江药业集团四川海蓉药业有限公司 2017-05-03 CN disclosed
CN-105853387-A Stable vildagliptin capsule drug composition 天津汉瑞药业有限公司 2016-08-17 CN disclosed
CN-105777602-A Stable vildagliptin compound 天津汉瑞药业有限公司 2016-07-20 CN disclosed
WO-2013020108-A2 BILE ACID RECYCLING INHIBITORS FOR TREATMENT OF PANCREATITIS Lumena Pharmaceuticals, Inc. (US) 2013-02-07 WO disclosed
CN-102316872-A Bile acid recycling inhibitor for treating obesity and diabetes SATIOGEN PHARMACEUTICALS INC 2012-01-11 CN disclosed
WO-2011150286-A2 BILE ACID RECYCLING INHIBITORS AND SATIOGENS FOR TREATMENT OF DIABETES, OBESITY, AND INFLAMMATORY GASTROINTESTINAL CONDITIONS SATIOGEN PHARMACEUTICALS,INC. (US) 2011-12-01 WO disclosed
CN-101208085-B Modified release formulations of 1- [ (3-hydroxy-adamantyl-1-ylamino) -acetyl ] -pyrrolidinyl-2(s) -carbonitrile NOVARTIS AG 2011-01-05 CN disclosed
CN-101932321-A Combination therapy comprising an SGLT inhibitor and a DPP4 inhibitor MITSUBISHI TANABE PHARMA CORP 2010-12-29 CN disclosed
WO-2010062863-A2 COMPOSITIONS CONTAINING SATIOGENS AND METHODS OF USE SATIOGEN PHARMACEUTICALS, INC. (US) 2010-06-03 WO disclosed
CN-101277719-A Medical agent containing insulin resistance improving agent DAIICHI SANKYO CO LTD (JP) 2008-10-01 CN disclosed
CN-101208085-A Modified release formulations of 1- [ (3-hydroxy-adamantyl-1-ylamino) -acetyl ] -pyrrolidinyl-2(s) -carbonitrile NOVARTIS AG (CH) 2008-06-25 CN disclosed
CN-1901881-A Compositions and dosage forms for enhanced absorption ALZA CORP (US) 2007-01-24 CN disclosed
CN-1700911-A Combination drug EISAI CO LTD (JP) 2005-11-23 CN disclosed