SCHEMBL9515429

SCHEMBL9515429

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

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 12/20 0.38
HDAC6 Q9UBN7 12/20 0.38
HDAC5 Q9UQL6 10/20 0.38
HDAC8 Q9BY41 6/20 0.38
HDAC3 O15379 2/20 0.37
HDAC2 Q92769 2/20 0.37
NAMPT P43490 3/20 0.37
SLC6A9 P48067 1/20 0.36
KLRK1 P26718 1/20 0.36
MICA Q29983 1/20 0.36
RAET1L Q5VY80 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.35
VNN1 O95497 1/20 0.35

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
SCHEMBL9519433 0.91 NAMPT (0.39) HDAC1HDAC6HDAC5HDAC8HDAC3
SCHEMBL9515967 0.89 HIF1A (0.38) HDAC1HDAC6HDAC5HDAC8HDAC3
SCHEMBL9515545 0.88 HDAC6 (0.36) HDAC1HDAC6HDAC5HDAC8HDAC3
SCHEMBL9517174 0.85 HDAC1 (0.39) HDAC1HDAC6HDAC5HDAC8HDAC3
SCHEMBL9519311 0.82 P4HTM (0.36) HDAC1HDAC6HDAC5HDAC8HDAC3
SCHEMBL9518012 0.82 MEN1 (0.37) HDAC1HDAC6HDAC5HDAC8HDAC3
SCHEMBL9515891 0.80 EGFR (0.41) HDAC1HDAC6HDAC5HDAC8HDAC3
SCHEMBL9516276 0.79 HIF1A (0.39) HDAC1HDAC6HDAC5HDAC8HDAC3
SCHEMBL9519439 0.79 PNMT (0.42) HDAC1HDAC6HDAC5HDAC8HDAC3
SCHEMBL9517180 0.79 PNMT (0.44) HDAC1HDAC6HDAC5HDAC8HDAC3

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