SCHEMBL2649927

SCHEMBL2649927

COc1ccccc1Oc1cc(F)ccc1NC(=O)C(=O)Nc1nc(CNS(C)(=O)=O)c(Br)s1.COc1ccccc1Oc1cc(F)ccc1NC(=O)C(=O)Nc1nc(CNS(C)(=O)=O)c(Cl)s1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCK P35557 2/20 0.38
CSNK1D P48730 3/20 0.37
MAPT P10636 5/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
RORC P51449 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 2/20 0.33
PI4KB Q9UBF8 1/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 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
SCHEMBL1342962 0.95 CSNK1D (0.40) CSNK1DMAPTSCN10ARORCSMN1; SMN2
SCHEMBL1342970 0.95 GCK (0.41) GCKCSNK1DMAPTSCN10ASMN1; SMN2
SCHEMBL2649924 0.92 GCK (0.35) GCKCSNK1DMAPTSCN10ARORC
SCHEMBL1343613 0.88 CSNK1D (0.43) CSNK1DMAPTSCN10ARORCSMN1; SMN2
SCHEMBL1342285 0.88 CSNK1D (0.43) GCKCSNK1DSCN10ARORCPI4KB
SCHEMBL1343206 0.87 RORC (0.39) CSNK1DMAPTRORCSMN1; SMN2LMNA
SCHEMBL1342752 0.87 MAPT (0.42) CSNK1DMAPTRORCSMN1; SMN2LMNA
SCHEMBL1342627 0.86 CSNK1D (0.40) CSNK1DMAPTSCN10ARORCPI4KB
SCHEMBL1342448 0.85 CSNK1D (0.40) CSNK1DMAPTSCN10ARORCPI4KB
SCHEMBL2649319 0.83 GAA (0.42) CSNK1DMAPTSMN1; SMN2LMNAKMT2A

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
EP-1531815-A1 GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2005-05-25 EP disclosed
WO-2004002481-A1 ARYL CARBONYL DERIVATIVES AS THERAPEUTIC AGENTS NOVO NORDISK A/S (DK) 2004-01-08 WO disclosed