SCHEMBL13866895

SCHEMBL13866895

CC#CCn1c(=O)n(Cc2ccccc2C(N)=O)c2nc(Cl)nc(N3CCNCC3)c21

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.45
FAP Q12884 5/20 0.41
DPP9 Q86TI2 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
P2RX3 P56373 1/20 0.38

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 SCHEMBL3881058 0.95 DPP4 (0.43) DPP4FAPDPP9L3MBTL1P2RX3
SCHEMBL13875681 0.89 DPP4 (0.42) DPP4L3MBTL1P2RX3
SCHEMBL13866891 0.85 DPP4 (0.60) DPP4FAPDPP9P2RX3
SCHEMBL3881063 0.83 DPP4 (0.42) DPP4FAPDPP9L3MBTL1P2RX3
Trifluoroacetic Acid SCHEMBL3885741 0.83 DPP4 (0.53) DPP4FAPDPP9P2RX3
SCHEMBL13866888 0.82 DPP4 (0.45) DPP4FAPDPP9L3MBTL1P2RX3
Trifluoroacetic Acid SCHEMBL3884728 0.82 DPP4 (0.46) DPP4FAPDPP9L3MBTL1P2RX3
SCHEMBL13866887 0.80 DPP4 (0.56) DPP4FAPDPP9
SCHEMBL13866884 0.80 DPP4 (0.45) DPP4FAPDPP9P2RX3
SCHEMBL13866882 0.78 DPP4 (0.50) DPP4FAPDPP9P2RX3

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