SCHEMBL13866869

SCHEMBL13866869

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

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 13/20 0.62
KMT2A Q03164 3/20 0.42
MAPK1 P28482 2/20 0.42
LMNA P02545 1/20 0.42
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KCNH2 Q12809 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39

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 SCHEMBL3886671 0.92 DPP4 (0.54) DPP4KMT2AMAPK1LMNAMEN1
SCHEMBL13866870 0.85 DPP4 (0.44) DPP4KMT2AMAPK1LMNAMEN1
SCHEMBL13876111 0.85 DPP4 (0.44) DPP4KMT2AMAPK1LMNAMEN1
SCHEMBL13875834 0.85 DPP4 (0.46) DPP4LMNAALDH1A1L3MBTL1
SCHEMBL13875675 0.84 DPP4 (0.45) DPP4ALDH1A1SMN1; SMN2L3MBTL1CYP1A2
SCHEMBL13866842 0.81 DPP4 (0.61) DPP4L3MBTL1
SCHEMBL13867030 0.81 DPP4 (0.57) DPP4KCNH2
SCHEMBL13866872 0.81 DPP4 (0.46) DPP4KMT2AALDH1A1L3MBTL1CYP1A2
SCHEMBL13866868 0.80 DPP4 (0.49) DPP4ALDH1A1L3MBTL1
Trifluoroacetic Acid SCHEMBL3872986 0.80 DPP4 (0.41) DPP4KMT2AMAPK1LMNAMEN1

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