SCHEMBL13866909

SCHEMBL13866909

CC#CCn1c(=O)n(-c2ccoc2)c2nc(Cl)nc(N3CCNCC3)c21

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.42
FAP Q12884 5/20 0.38
DPP9 Q86TI2 1/20 0.37
KCNH2 Q12809 2/20 0.34
CHRM1 P11229 2/20 0.33
P2RX3 P56373 1/20 0.32

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 SCHEMBL3875903 0.93 DPP4 (0.39) DPP4FAPDPP9CHRM1P2RX3
SCHEMBL13866936 0.88 DPP4 (0.40) DPP4FAPDPP9KCNH2CHRM1
SCHEMBL13866899 0.87 DPP4 (0.51) DPP4FAPDPP9KCNH2CHRM1
SCHEMBL13866966 0.85 DPP4 (0.41) DPP4FAPDPP9KCNH2CHRM1
SCHEMBL13866910 0.85 DPP4 (0.45) DPP4FAPDPP9KCNH2CHRM1
SCHEMBL13866905 0.85 DPP4 (0.44) DPP4FAPDPP9KCNH2
SCHEMBL13866907 0.84 CYP1A2 (0.42) DPP4FAPDPP9CHRM1
SCHEMBL13866913 0.83 DPP4 (0.43) DPP4FAPDPP9KCNH2CHRM1
Trifluoroacetic Acid SCHEMBL3872972 0.82 DPP4 (0.37) DPP4FAPDPP9CHRM1
Trifluoroacetic Acid SCHEMBL3885657 0.81 DPP4 (0.46) DPP4FAPDPP9KCNH2CHRM1

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