SCHEMBL47756

SCHEMBL47756

NC(=O)c1ccnc(-c2cc(OC3CCCC3)ccc2NC(=O)c2cccc(CCCOCCOCCOCCOCCC(=O)O)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC34A2 O95436 1/20 0.44
OPRK1 P41145 7/20 0.38
KCNH2 Q12809 6/20 0.38
OPRM1 P35372 5/20 0.38
OPRD1 P41143 3/20 0.38
F2 P00734 1/20 0.36
PLG P00747 1/20 0.36
PLAU P00749 1/20 0.36
PLAT P00750 1/20 0.36
KLKB1 P03952 1/20 0.36
PRSS1 P07477 1/20 0.36
KMT2A Q03164 1/20 0.34
FFAR4 Q5NUL3 3/20 0.34
CYSLTR2 Q9NS75 1/20 0.34
CYSLTR1 Q9Y271 1/20 0.34
CYP4F2 P78329 3/20 0.33
CYP4A11 Q02928 3/20 0.33
LNPEP Q9UIQ6 1/20 0.33
TOP2A P11388 1/20 0.33
PDE4D Q08499 1/20 0.33

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
SCHEMBL6001503 0.99 SLC34A2 (0.44) SLC34A2OPRK1KCNH2OPRM1OPRD1
SCHEMBL19596069 0.88 SLC34A2 (0.41) SLC34A2KMT2AFFAR4CYSLTR2CYSLTR1
SCHEMBL15432965 0.86 MEN1 (0.41) SLC34A2KMT2A
SCHEMBL18471366 0.86 MEN1 (0.41) SLC34A2KMT2A
SCHEMBL15444467 0.85 MEN1 (0.41) SLC34A2KMT2A
SCHEMBL15432931 0.85 MEN1 (0.41) SLC34A2KMT2A
SCHEMBL19596014 0.84 SLC34A2 (0.38) SLC34A2OPRK1KCNH2OPRM1F2
SCHEMBL19596051 0.84 SLC34A2 (0.44) SLC34A2KMT2A
SCHEMBL19595763 0.82 SLC34A2 (0.62) SLC34A2TOP2A
SCHEMBL19595744 0.82 SLC34A2 (0.62) SLC34A2TOP2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2590656-B1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX INC (US) 2017-11-15 EP disclosed
WO-2012054110-A2 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2012-04-26 WO disclosed
WO-2012006475-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2012-01-12 WO disclosed