SCHEMBL8923905

SCHEMBL8923905

CCOc1ccc(-c2nc(-c3ccc(NC=S)cc3)cs2)cc1OCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.53
PDE4B Q07343 1/20 0.53
PDE4C Q08493 1/20 0.53
PDE4D Q08499 1/20 0.53
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 2/20 0.47
CDC25A P30304 1/20 0.45
CDC25B P30305 1/20 0.45
CDC25C P30307 1/20 0.45
DUSP3 P51452 1/20 0.45
SREBF2 Q12772 8/20 0.44
SREBF1 P36956 2/20 0.43
NPSR1 Q6W5P4 1/20 0.42
CYP19A1 P11511 1/20 0.42
S1PR1 P21453 1/20 0.42
PTPN7 P35236 1/20 0.42
PTPN22 Q9Y2R2 1/20 0.42
FPR2 P25090 1/20 0.42
MAPT P10636 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL8924814 0.83 PDE4A (0.62) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL8923717 0.82 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL6194685 0.82 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL6199824 0.81 PDE4A (0.61) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL6202837 0.81 SREBF2 (0.60) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL6199960 0.80 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DKDM4E
Hydrochloric Acid SCHEMBL6199487 0.80 SREBF2 (0.59) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7499471 0.78 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7499486 0.78 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DKDM4E
Iodide SCHEMBL6202003 0.78 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DKDM4E

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-5639770-A SUPEROXIDE INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-06-17 US disclosed
EP-0600092-A1 THIAZOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-08 EP disclosed