SCHEMBL10057896

SCHEMBL10057896

CCN1C(C#N)CC2CC21

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.42
CYP3A4 P08684 1/20 0.33

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
SCHEMBL23378932 0.71
SCHEMBL21259965 0.71
SCHEMBL7931322 0.71
SCHEMBL10060826 0.71
SCHEMBL8301669 0.70 DPP4 (0.47) DPP4
SCHEMBL23378947 0.69 DPP4 (0.47) DPP4
SCHEMBL23379722 0.69 DPP4 (0.47) DPP4
SCHEMBL23378743 0.67 DPP4 (0.42) DPP4
SCHEMBL13985991 0.67
SCHEMBL890131 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012017391-A2 NOVEL COMPOUNDS AS DPP-IV INHIBITORS AND PROCESS FOR PREPARATION THEREOF CADILA PHARMACEUTICALS LIMITED (IN) 2012-02-09 WO disclosed