SCHEMBL12634883

SCHEMBL12634883

CCn1c(COC(=O)c2nc(Cl)c(N)nc2N)[n+](CC)c2ccc(SC(F)(F)F)cc21

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD5 P21918 1/20 0.37
SCNN1A P37088 1/20 0.37
SCNN1B P51168 1/20 0.37
SCNN1G P51170 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.31
NPC1 O15118 1/20 0.31
MITF O75030 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
PABPC1 P11940 1/20 0.31

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
Iodide SCHEMBL2017707 0.99 DRD5 (0.36) DRD5SCNN1ASCNN1BSCNN1GHRH3
Iodide SCHEMBL2018595 0.86 DRD5 (0.39) DRD5SCNN1ASCNN1BSCNN1GHRH3
SCHEMBL12635766 0.86 SCNN1A (0.51) DRD5SCNN1ASCNN1BSCNN1GHRH3
Iodide SCHEMBL2018318 0.85 SCNN1A (0.50) DRD5SCNN1ASCNN1BSCNN1GHRH3
Iodide SCHEMBL2019947 0.84 DRD5 (0.39) DRD5SCNN1ASCNN1BSCNN1GHRH3
Iodide SCHEMBL2022260 0.83 SCNN1A (0.38) DRD5SCNN1ASCNN1BSCNN1GHRH3
SCHEMBL2016440 0.82 ALDH1A1 (0.37) DRD5SCNN1ASCNN1BSCNN1GHRH3
SCHEMBL12635937 0.82 DRD5 (0.38) DRD5SCNN1ASCNN1BSCNN1GHRH3
Iodide SCHEMBL2024368 0.81 ALDH1A1 (0.36) DRD5SCNN1ASCNN1BSCNN1GHRH3
Iodide SCHEMBL2014693 0.81 SCNN1A (0.37) DRD5SCNN1ASCNN1BSCNN1GHRH3

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
WO-2011079087-A1 ENAC BLOCKERS GLAXO GROUP LIMITED (GB) 2011-06-30 WO disclosed