SCHEMBL11569347

SCHEMBL11569347

CCCCCCCCNS(=O)(=O)c1cc(Cl)ccc1C(=O)CCC(=O)NC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.46
▸ CA9 Q16790 2/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ TSHR P16473 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PDK1 Q15118 2/20 0.42
▸ PDK2 Q15119 2/20 0.42
▸ PDK3 Q15120 2/20 0.42
▸ PDK4 Q16654 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ ALDH1A1 P00352 4/20 0.41

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
SCHEMBL11347459 0.80 MEN1 (0.46) CA12CA9MEN1TSHRKMT2A
SCHEMBL11353531 0.80 MEN1 (0.46) CA12CA9MEN1TSHRKMT2A
SCHEMBL197721 0.76 GAA (0.68) CA12CA9MEN1TSHRKMT2A
SCHEMBL197333 0.76 GAA (0.68) CA12CA9MEN1TSHRKMT2A
SCHEMBL11348810 0.70 GSTO1 (0.44) CA12CA9MEN1TSHRKMT2A
SCHEMBL3116881 0.69 CNR1 (0.56) CA12CA9MEN1TSHRKMT2A
SCHEMBL11345142 0.69 FABP4 (0.49) CA12CA9MEN1TSHRKMT2A
SCHEMBL5506453 0.69 FABP4 (0.49) CA12CA9MEN1TSHRKMT2A
SCHEMBL6836177 0.69 ACLY (0.61) CA12CA9MEN1TSHRKMT2A
SCHEMBL9577219 0.68 GAA (0.73) MEN1TSHRKMT2ATP53CYP1A2

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-0001051-A2 Derivatives of benzenesulfonamide, method for their preparation and pharmaceutical compositions containing them HOECHST AKTIENGESELLSCHAFT (DE) 1979-03-21 — — EP disclosed
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