SCHEMBL295963

SCHEMBL295963

CC(C)C(C)n1c(=O)n(C)c(=O)c2[nH]cnc21

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 8/20 0.78
ATAD2 Q6PL18 1/20 0.64
ADORA2A P29274 10/20 0.62
PDE4A P27815 9/20 0.62
PDE4B Q07343 9/20 0.62
PDE4C Q08493 9/20 0.62
PDE4D Q08499 9/20 0.62
ADORA1 P30542 2/20 0.62
ADORA3 P0DMS8 2/20 0.62
PIK3CD O00329 1/20 0.62
ALPL P05186 1/20 0.62
TMIGD3 P0DMS9 1/20 0.62
CYP2C19 P33261 1/20 0.62
HIF1A Q16665 1/20 0.62
CYP1A2 P05177 2/20 0.59
CFTR P13569 2/20 0.59
MAPK1 P28482 2/20 0.59
PDE2A O00408 2/20 0.59
PDE1A P54750 2/20 0.59
PDE1B Q01064 2/20 0.59

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
SCHEMBL23073728 0.88 ADORA2B (1.00) ADORA2BATAD2ADORA2APDE4APDE4B
SCHEMBL7554983 0.85 ADORA2B (0.74) ADORA2BATAD2ADORA2APDE4APDE4B
SCHEMBL28137652 0.83 ADORA2B (0.75) ADORA2BATAD2ADORA2APDE4APDE4B
Theophylline Anhydrous SCHEMBL28870701 0.82 ADORA2B (0.83) ADORA2BATAD2ADORA2APDE4APDE4B
Theophylline Anhydrous SCHEMBL28323421 0.79 ATAD2 (0.93) ADORA2BATAD2ADORA2APDE4APDE4B
Theophylline Anhydrous SCHEMBL4915 0.79 ATAD2 (1.00) ADORA2BATAD2ADORA2APDE4APDE4B
Theophylline Anhydrous SCHEMBL8595167 0.79 ATAD2 (1.00) ADORA2BATAD2ADORA2APDE4APDE4B
Theophylline Anhydrous SCHEMBL25398274 0.79 ATAD2 (1.00) ADORA2BATAD2ADORA2APDE4APDE4B
Theophylline Anhydrous SCHEMBL3051675 0.79 ATAD2 (1.00) ADORA2BATAD2ADORA2APDE4APDE4B
Theophylline Anhydrous SCHEMBL8375983 0.77 ATAD2 (0.96) ADORA2BATAD2ADORA2APDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8957020-B2 Mnk kinase homologous proteins involved in the regulation of energy homeostasis and organelle metabolism BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-02-17 US disclosed
US-8828934-B2 Mnk kinase homologous proteins involved in the regulation of energy homeostasis and organelle metabolism BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-09-09 US disclosed
US-20140213510-A1 USE OF PLEITROPHIN FOR PREVENTING AND TREATING PANCREATIC DISEASES AND/OR OBESITY AND/OR METABOLIC SYNDROME EVOTEC INTERNATIONAL GMBH (DE) 2014-07-31 US disclosed
EP-2289908-B1 Use of DG177 secreted protein products for preventing and treating pancreatic diseases and/or obesity and/or metabolic syndrome EVOTEC INTERNAT GMBH (DE) 2013-08-07 EP disclosed
US-8501473-B2 Use of pleitrophin for preventing and treating pancreatic diseases and/or obesity and/or metabolic syndrome EVOTEC INTERNATIONAL GMBH (DE) 2013-08-06 US disclosed
EP-1605965-B1 USE OF SAPOSIN-RELATED PROTEINS FOR PREVENTING AND TREATING OBESITY, DIABETES AND/OR METABOLIC SYNDROME DEVELOGEN AG (DE) 2012-12-26 EP disclosed
EP-1644406-B1 USE OF DG153 SECRETED PROTEIN PRODUCTS FOR PREVENTING AND TREATING PANCREATIC DISEASES AND/OR OBESITY AND/OR METABOLIC SYNDROME DEVELOGEN AG (DE) 2012-08-15 EP disclosed
EP-2096120-B1 Use of secreted protein products for preventing and treating pancreatic diseases and/or obesity and/or metabolic syndrome DEVELOGEN AG (DE) 2012-03-14 EP disclosed
US-20120045451-A1 Mnk KINASE HOMOLOGOUS PROTEINS INVOLVED IN THE REGULATION OF ENERGY HOMEOSTASIS AND ORGANELLE METABOLISM DEVELOGEN AKTIENGESELLSCHAFT FUER ENTWICKLUNGSBIOLOGISCHE FORSCHUNG (DE) 2012-02-23 US disclosed
US-20120045452-A1 Mnk KINASE HOMOLOGOUS PROTEINS INVOLVED IN THE REGULATION OF ENERGY HOMEOSTASIS AND ORGANELLE METABOLISM DEVELOGEN AKTIENGESELLSCHAFT FUER ENTWICKLUNGSBIOLOGISCHE FORSCHUNG (DE) 2012-02-23 US disclosed
WO-2004031392-A1 MIPP1 HOMOLOGOUS NUCLEIC ACIDS AND PROTEINS INVOLVED IN THE REGULATION OF ENERGY HOMEOSTATIS DeveloGen Aktiengesellschaft für entwicklungsbiologische Forschung (DE) 2004-04-15 WO disclosed
WO-2004028554-A2 SKRP, ASTRAY, STRING, VACM ASSOCIATED WITH METABOLIC CONTROL DeveloGen Aktiengesellschaft für entwicklungsbiologische Forschung (DE) 2004-04-08 WO disclosed
WO-2004022089-A1 MINIBRAIN HOMOLOGOUS PROTEINS INVOLVED IN THE REGULATION OF ENERGY HOMEOSTASIS DeveloGen Aktiengesellschaft für entwicklungsbiologische Forschung (DE) 2004-03-18 WO disclosed
WO-2004020465-A2 PROTEINS INVOLVED IN THE REGULATION OF ENERGY HOMEOSTASIS DeveloGen Aktiengesellschaft für entwicklungsbiologische Forschung (DE) 2004-03-11 WO disclosed
WO-2004016641-A2 PROTEINS INVOLVED IN THE REGULATION OF ENERGY HOMEOSTASIS DeveloGen Aktiengesellschaft für entwicklungsbiologische Forschung (DE) 2004-02-26 WO disclosed
WO-2004012758-A1 USE OF TGF BETA IG-H3 FOR PREVENTING AND TREATING OBESITY, DIABETES AND/OR METABOLIC SYNDROME DeveloGen Aktiengesellschaft für entwicklungsbiologische Forschung (DE) 2004-02-12 WO disclosed
WO-2003074078-A2 CG3842 HOMOLOGOUS PROTEINS INVOLVED IN THE REGULATION OF ENERGY HOMEOSTASIS DeveloGen Aktiengesellschaft für entwicklungsbiologische Forschung (DE) 2003-09-12 WO disclosed
WO-2003047611-A2 PTP10D, TEC AND EDTP INVOLVED IN TRIGLYCERID-METABOLISM DeveloGen Aktiengesellschaft für entwicklungsbiologische Forschung (DE) 2003-06-12 WO disclosed
WO-2003039574-A1 ENDOPHILIN HOMOLOGOUS PROTEINS INVOLVED IN THE REGULATION OF ENERGY HOMEOSTASIS DEVELOGEN AKTIENGESELLSCHAFT FÜR ENTIWICKLUNGSBIOLOGISCHE FORSCHUNG (DE) 2003-05-15 WO disclosed
WO-2003037362-A2 MNK KINASE HOMOLOGOUS PROTEINS INVOLVED IN THE REGULATION OF ENERGY HOMEOSTASIS AND ORGANELLE METABOLISM DeveloGen Aktiengesellschaft für entwicklungsbiologische Forschung (DE) 2003-05-08 WO disclosed