SCHEMBL5560029

SCHEMBL5560029

Cc1ccccc1C(=O)c1cnc(Nc2ccc(NS(=O)(=O)c3ccc(Cl)s3)cc2)s1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.54
MAPK13 O15264 9/20 0.54
MAPK12 P53778 9/20 0.54
MAPK11 Q15759 9/20 0.54
MAPT P10636 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
RECQL P46063 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
PABPC1 P11940 1/20 0.45

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
SCHEMBL5560947 0.92 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5396650 0.88 MAPK13 (0.50) MAPK14MAPK13MAPK12MAPK11MAPT
SCHEMBL5400048 0.85 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11MAPT
SCHEMBL5401082 0.85 MAPK13 (0.54) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2
SCHEMBL27666765 0.84 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11MAPT
SCHEMBL5392484 0.82 MAPK13 (0.49) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5393306 0.82 MAPK13 (0.61) MAPK14MAPK13MAPK12MAPK11NPC1
SCHEMBL5409011 0.82 MAPK13 (0.53) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2
SCHEMBL5403354 0.81 ALDH1A1 (0.50) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2
SCHEMBL5560708 0.81 MAPK13 (0.49) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2

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-1658288-B1 2-AMINO-5-BENZOYLTHIAZOLE NPY ANTAGONISTS HOFFMANN LA ROCHE (CH) 2007-12-05 EP claimed