SCHEMBL13875686

SCHEMBL13875686

C=CCn1c(=O)n(CC)c2c(N3CCNCC3)ncnc21

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.43
ADORA2B P29275 4/20 0.43
TLR7 Q9NYK1 1/20 0.41
ADORA2A P29274 3/20 0.38
PDE4A P27815 2/20 0.37
PDE4B Q07343 2/20 0.37
PDE4C Q08493 2/20 0.37
PDE4D Q08499 2/20 0.37
HTR3A P46098 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ENPP1 P22413 1/20 0.33
CYP3A4 P08684 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL13866993 0.86 DPP4 (0.44) HTR2CADORA2BTLR7ADORA2APDE4A
SCHEMBL13875892 0.85 HTR2C (0.44) HTR2CADORA2BTLR7ADORA2APDE4A
SCHEMBL13875889 0.82 HTR2C (0.43) HTR2CADORA2BTLR7ALDH1A1ENPP1
SCHEMBL13875776 0.81 HTR2C (0.42) HTR2CTLR7PDE4APDE4BPDE4C
Trifluoroacetic Acid SCHEMBL3873547 0.79 DPP4 (0.38) HTR2CADORA2B
SCHEMBL13876133 0.74 DPP4 (0.57) KMT2ACYP3A4LMNA
SCHEMBL13867003 0.73 DPP4 (0.44) HTR2C
SCHEMBL13867030 0.73 DPP4 (0.57) HTR2CTLR7
SCHEMBL13875903 0.72 HTR2C (0.50) HTR2CTLR7ALDH1A1HTT
SCHEMBL13876313 0.72 HTR2C (0.38) HTR2CTLR7

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