SCHEMBL3892155

SCHEMBL3892155

CC#CCn1c(N2CCCC(N)C2)nc2c1c(=O)n(CC(=O)Nc1ccncc1)c(=O)n2C

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.71
CHRM1 P11229 3/20 0.71
GPR119 Q8TDV5 1/20 0.66

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
SCHEMBL3904016 0.93 DPP4 (0.79) DPP4CHRM1GPR119
SCHEMBL3904026 0.93 DPP4 (0.79) DPP4CHRM1GPR119
SCHEMBL3892177 0.93 DPP4 (0.69) DPP4CHRM1GPR119
SCHEMBL3892157 0.92 DPP4 (0.75) DPP4CHRM1GPR119
SCHEMBL3904090 0.91 DPP4 (0.69) DPP4CHRM1GPR119
SCHEMBL3904102 0.91 DPP4 (0.69) DPP4CHRM1GPR119
SCHEMBL3889624 0.90 DPP4 (0.68) DPP4CHRM1GPR119
SCHEMBL3889582 0.90 DPP4 (0.76) DPP4CHRM1GPR119
SCHEMBL3895427 0.90 DPP4 (0.70) DPP4CHRM1GPR119
SCHEMBL3894198 0.90 DPP4 (0.70) DPP4CHRM1

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
US-7560450-B2 Xanthine derivatives, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO., KG (DE) 2009-07-14 US disclosed