SCHEMBL9076980

SCHEMBL9076980

S=c1c2c(ncn2Cc2ccccc2)c2cccnc2n1-c1ccccc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 8/20 0.75
PDE4B Q07343 6/20 0.57
PDE4C Q08493 6/20 0.57
PDE4D Q08499 6/20 0.57
PDE1A P54750 1/20 0.43
PDE1B Q01064 1/20 0.43
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
ADORA2A P29274 1/20 0.40
PI4KA P42356 1/20 0.40
PI4K2B Q8TCG2 1/20 0.40
PI4K2A Q9BTU6 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
POLB P06746 1/20 0.39
HTR6 P50406 1/20 0.39
FEN1 P39748 1/20 0.39
APP P05067 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
SCHEMBL9078544 0.92 PDE4A (0.65) PDE4APDE4BPDE4CPDE4DPDE1A
SCHEMBL7272788 0.86 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE1A
SCHEMBL9413163 0.84 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DPDE1A
SCHEMBL7280534 0.81 PDE4A (0.83) PDE4APDE4BPDE4CPDE4DPDE1A
SCHEMBL9079411 0.80 PDE4A (0.73) PDE4APDE4BPDE4CPDE4DPDE1A
SCHEMBL7281912 0.80 PDE4A (0.87) PDE4APDE4BPDE4CPDE4DPDE1A
SCHEMBL29416766 0.79 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DPDE1A
SCHEMBL7271255 0.79 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DPDE1A
SCHEMBL2278414 0.79 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DPDE1A
SCHEMBL7279910 0.79 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DPDE1A

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-5484924-A ANTIALLERGEN, ANTIINFLAMMATORY, ANTIASTHMA KYOWA HAKKO KOGYO CO., LTD. (JP) 1996-01-16 US disclosed
EP-0614897-A1 IMIDAZONAPHTHYRIDINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-09-14 EP disclosed