SCHEMBL9077293

SCHEMBL9077293

S=c1c2[nH]cnc2c2cccnc2n1-c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 8/20 0.72
PDE4B Q07343 7/20 0.72
PDE4C Q08493 7/20 0.72
PDE4D Q08499 7/20 0.72
FEN1 P39748 1/20 0.43
PDE1A P54750 1/20 0.42
PDE1B Q01064 1/20 0.42
ALDH1A1 P00352 3/20 0.42
LOXL3 P58215 1/20 0.42
LOXL2 Q9Y4K0 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
LDHA P00338 1/20 0.40
MAPK1 P28482 1/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM4E B2RXH2 1/20 0.38
PRNP P04156 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
RXFP1 Q9HBX9 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
SCHEMBL7271411 0.84 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DFEN1
SCHEMBL2457079 0.78 PDE4A (0.81) PDE4APDE4BPDE4CPDE4DFEN1
SCHEMBL7280371 0.73 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DFEN1
SCHEMBL9079411 0.72 PDE4A (0.73) PDE4APDE4BPDE4CPDE4DFEN1
SCHEMBL7273701 0.71 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DFEN1
SCHEMBL7279657 0.70 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DFEN1
SCHEMBL7340105 0.70 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DPDE1A
SCHEMBL2294487 0.69 PDE4A (0.51) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7328426 0.69 PDE4A (0.71) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL9076980 0.69 PDE4A (0.75) PDE4APDE4BPDE4CPDE4DFEN1

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