SCHEMBL13866844

SCHEMBL13866844

CC#CCn1c(=O)n(C)c2nc(N(C)C)nc(N3CCNCC3)c21

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.59
FAP Q12884 6/20 0.47
DPP9 Q86TI2 1/20 0.44

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
Trifluoroacetic Acid SCHEMBL3881053 0.92 DPP4 (0.51) DPP4FAPDPP9
SCHEMBL13866843 0.89 DPP4 (0.57) DPP4FAPDPP9
SCHEMBL13866842 0.84 DPP4 (0.61) DPP4FAPDPP9
SCHEMBL13866846 0.84 DPP4 (0.61) DPP4FAPDPP9
SCHEMBL13866848 0.84 DPP4 (0.61) DPP4FAPDPP9
SCHEMBL13866841 0.83 DPP4 (0.59) DPP4FAPDPP9
SCHEMBL13866845 0.83 DPP4 (0.59) DPP4FAPDPP9
SCHEMBL13866849 0.83 DPP4 (0.59) DPP4FAPDPP9
Trifluoroacetic Acid SCHEMBL3875644 0.82 DPP4 (0.49) DPP4FAPDPP9
SCHEMBL13866862 0.81 DPP4 (0.57) DPP4FAPDPP9

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-7524847-B2 Fused 1,3-dihydro-imidazole ring compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-04-28 US disclosed