SCHEMBL11472002

SCHEMBL11472002

CC1C(=O)NN=C(c2ccccc2)C1C

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.59
PDE3B Q13370 2/20 0.56
PDE3A Q14432 2/20 0.56
PDE4A P27815 1/20 0.56
PDE4B Q07343 1/20 0.56
PDE4C Q08493 1/20 0.56
PDE4D Q08499 1/20 0.56
KDM4E B2RXH2 2/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
GFER P55789 1/20 0.39
HSD17B10 Q99714 1/20 0.39
AXL P30530 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
SCHEMBL6400925 0.80 PDE3B (0.56) GPR119PDE3BPDE3APDE4APDE4B
SCHEMBL13400655 0.77 ALDH1A1 (0.41) GPR119KDM4EKMT2AGAAMEN1
SCHEMBL13400652 0.77 ALDH1A1 (0.41) GPR119KDM4EKMT2AGAAMEN1
SCHEMBL2591981 0.76 GPR119 (1.00) GPR119
SCHEMBL2592363 0.76 GPR119 (1.00) GPR119
SCHEMBL7305470 0.76 KDM4E (0.41) GPR119KDM4EKMT2AGAAMEN1
SCHEMBL10814317 0.74 GPR119 (0.59) GPR119PDE3BPDE3APDE4APDE4B
SCHEMBL8110180 0.73 PDE3B (0.48) GPR119PDE3BPDE3APDE4APDE4B
SCHEMBL11092220 0.73 GPR119 (0.60) GPR119PDE4APDE4BPDE4CPDE4D
SCHEMBL11369154 0.73 GPR119 (0.60) GPR119

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-4230705-A 6-Phenyl-1,2,4-triazolo[4,3-b]pyridazines and their uses in treating anxiety AMERICAN CYANAMID COMPANY (US) 1980-10-28 US disclosed