SCHEMBL9517174

SCHEMBL9517174

O=CC(c1cccc(C(F)(F)F)c1)S(=O)(=O)NC(=O)c1ccc(CO)nc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 12/20 0.39
HDAC6 Q9UBN7 12/20 0.39
HDAC3 O15379 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC5 Q9UQL6 10/20 0.39
HDAC8 Q9BY41 6/20 0.39
NAMPT P43490 3/20 0.39
SLC6A9 P48067 1/20 0.38
KLRK1 P26718 1/20 0.38
MICA Q29983 1/20 0.38
RAET1L Q5VY80 1/20 0.38
CASP3 P42574 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37

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
SCHEMBL9519391 0.88 HDAC6 (0.38) HDAC1HDAC6HDAC3HDAC2HDAC5
SCHEMBL9519634 0.87 HDAC1 (0.39) HDAC1HDAC6HDAC3HDAC2HDAC5
SCHEMBL9517025 0.87 CASP3 (0.39) HDAC1HDAC6HDAC3HDAC2HDAC5
SCHEMBL9519433 0.87 NAMPT (0.39) HDAC1HDAC6HDAC3HDAC2HDAC5
SCHEMBL9517165 0.86 VNN1 (0.40) HDAC1HDAC6HDAC3HDAC2HDAC5
SCHEMBL9515429 0.85 HDAC1 (0.38) HDAC1HDAC6HDAC3HDAC2HDAC5
SCHEMBL9517180 0.82 PNMT (0.44) HDAC1HDAC6HDAC3HDAC2HDAC5
SCHEMBL9518019 0.81 MEN1 (0.39) HDAC1HDAC6HDAC3HDAC2HDAC5
SCHEMBL9519439 0.80 PNMT (0.42) HDAC1HDAC6HDAC3HDAC2HDAC5
SCHEMBL9515431 0.79 PNMT (0.41) HDAC1HDAC6HDAC3HDAC2HDAC5

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-0567997-A1 4- or 5-(sulf)imido- and (sulfon)amidopyridines and their pyridine-N-oxides, process for their preparation and their use as pharmaceutical HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-03 EP disclosed