SCHEMBL15533861

SCHEMBL15533861

CC#CCN1c2c(n(C)c(=O)[nH]c2=O)N(Cc2ncccc2C#N)C1N1CCC[C@@H](N)C1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.43
KCNH2 Q12809 3/20 0.43
TNKS O95271 1/20 0.37
PARP1 P09874 1/20 0.37
TNKS2 Q9H2K2 1/20 0.37

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
SCHEMBL15533388 0.88 DPP4 (0.47) DPP4
SCHEMBL15533200 0.86 DPP4 (0.42) DPP4KCNH2
SCHEMBL15533174 0.80 DPP4 (0.53) DPP4KCNH2
SCHEMBL160189 0.79 DPP4 (0.53) DPP4KCNH2
SCHEMBL15516850 0.79 DPP4 (0.53) DPP4KCNH2
SCHEMBL24743941 0.76 DPP4 (0.51) DPP4KCNH2
SCHEMBL15091721 0.75 DPP4 (0.34) DPP4
SCHEMBL20528287 0.74 DPP4 (0.51) DPP4
SCHEMBL12047552 0.70 DPP4 (0.79) DPP4KCNH2
SCHEMBL12047731 0.70 DPP4 (0.68) DPP4KCNH2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3125882-A2 TREATMENT OF METABOLIC DISORDERS IN EQUINE ANIMALS Boehringer Ingelheim Vetmedica GmbH (DE) 2017-02-08 EP disclosed
EP-3096765-A1 TREATMENT OF METABOLIC DISORDERS IN CANINE ANIMALS Boehringer Ingelheim Vetmedica GmbH (DE) 2016-11-30 EP disclosed
EP-3082829-A1 TREATMENT OF METABOLIC DISORDERS IN FELINE ANIMALS Boehringer Ingelheim Vetmedica GmbH (DE) 2016-10-26 EP disclosed
EP-2981269-A1 TREATMENT OF METABOLIC DISORDERS IN EQUINE ANIMALS Boehringer Ingelheim Vetmedica GmbH (DE) 2016-02-10 EP disclosed
WO-2015150299-A2 TREATMENT OF METABOLIC DISORDERS IN EQUINE ANIMALS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2015-10-08 WO disclosed
WO-2015110402-A1 TREATMENT OF METABOLIC DISORDERS IN CANINE ANIMALS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2015-07-30 WO disclosed
WO-2015091313-A1 TREATMENT OF METABOLIC DISORDERS IN FELINE ANIMALS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2015-06-25 WO disclosed
EP-2854824-A1 USE OF KERATINOCYTES AS A BIOLOGICALLY ACTIVE SUBSTANCE IN THE TREATMENT OF WOUNDS, SUCH AS DIABETIC WOUNDS, OPTIONALLY IN COMBINATION WITH A DPP-4 INHIBITOR Boehringer Ingelheim International GmbH (DE) 2015-04-08 EP disclosed
WO-2014161836-A1 TREATMENT OF METABOLIC DISORDERS IN EQUINE ANIMALS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2014-10-09 WO disclosed
WO-2013174769-A1 USE OF KERATINOCYTES AS A BIOLOGICALLY ACTIVE SUBSTANCE IN THE TREATMENT OF WOUNDS, SUCH AS DIABETIC WOUNDS, OPTIONALLY IN COMBINATION WITH A DPP-4 INHIBITOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-11-28 WO disclosed