SCHEMBL19857039

SCHEMBL19857039

FC(F)(F)Oc1ccc(-c2cccc(OCc3ncccn3)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 2/20 0.46
SLC6A7 Q99884 1/20 0.46
KCNH2 Q12809 2/20 0.45
SCN1A P35498 1/20 0.45
SCN4A P35499 1/20 0.45
SCN9A Q15858 1/20 0.45
SCN2A Q99250 1/20 0.45
SCN3A Q9NY46 1/20 0.45
SCN8A Q9UQD0 1/20 0.45
SCN10A Q9Y5Y9 1/20 0.45
GRM5 P41594 1/20 0.43
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
PPARD Q03181 2/20 0.42
DYRK1A Q13627 1/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
KCNA5 P22460 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
SCHEMBL16824800 0.83 PDE4A (0.48) KCNH2GRM5PDE4APDE4BPDE4C
SCHEMBL19857041 0.83 PPARD (0.45) SCN5ASLC6A7PDE4APDE4BPDE4C
SCHEMBL16824803 0.83 SLC6A7 (0.42) SCN5ASLC6A7KCNH2GRM5PDE4A
SCHEMBL19857042 0.82 PDE4A (0.45) SCN5AKCNH2SCN10AGRM5PDE4A
SCHEMBL19857043 0.80 CTSA (0.51) GRM5PDE4APDE4BPDE4CPDE4D
SCHEMBL16824812 0.78 MRGPRX4 (0.40) SCN5ASLC6A7KCNH2SCN10APPARD
SCHEMBL29628993 0.77 SCN5A (0.54) SCN5ASCN1ASCN2ACA12CA9
SCHEMBL16821894 0.76 GRM5 (0.45) SLC6A7KCNH2GRM5DYRK1AKCNA5
SCHEMBL16821778 0.75 SCN5A (0.42) SCN5AKCNH2SCN1ASCN4ASCN9A
SCHEMBL30340908 0.73 NPC1 (0.60) SLC6A7KCNH2GRM5PDE4APDE4B

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
EP-3092234-B1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD SCIENCES INC (US) 2018-02-14 EP disclosed