SCHEMBL8923947

SCHEMBL8923947

CCOc1ccc(-c2nc(-c3ccc(O)c(C(=O)NN)c3)cs2)cc1OCC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.56
PDE4B Q07343 1/20 0.56
PDE4C Q08493 1/20 0.56
PDE4D Q08499 1/20 0.56
EIF4E P06730 2/20 0.46
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 4/20 0.43
CDC25A P30304 2/20 0.43
CDC25B P30305 2/20 0.43
CDC25C P30307 2/20 0.43
DUSP3 P51452 2/20 0.43
MAPT P10636 5/20 0.42
THRB P10828 1/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
POLB P06746 3/20 0.42
GAA P10253 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
RAB9A P51151 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL8922392 0.93 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DEIF4E
SCHEMBL6200469 0.90 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DEIF4E
SCHEMBL6199473 0.89 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DEIF4E
SCHEMBL6198018 0.89 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DEIF4E
SCHEMBL4653815 0.89 PDE4A (0.64) PDE4APDE4BPDE4CPDE4DEIF4E
SCHEMBL8924567 0.85 PDE4A (0.60) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL6195269 0.85 ALDH1A1 (0.53) PDE4APDE4BPDE4CPDE4DEIF4E
Hydrochloric Acid SCHEMBL8924752 0.84 PDE4A (0.59) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL6199821 0.84 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DEIF4E
SCHEMBL6197146 0.84 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DEIF4E

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 4 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 claimed
EP-0600092-A1 THIAZOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-08 EP claimed
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