SCHEMBL8989782

SCHEMBL8989782

Nc1ccc(S(=O)(=O)Oc2ccccc2)c(N)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.46
CA2 P00918 4/20 0.46
CA9 Q16790 4/20 0.46
LMNA P02545 2/20 0.41
MAOB P27338 1/20 0.39
TDP1 Q9NUW8 3/20 0.39
MAOA P21397 1/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
CYP3A4 P08684 3/20 0.37
MAPT P10636 2/20 0.37
TP53 P04637 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ADORA3 P0DMS8 1/20 0.37
CHRM1 P11229 1/20 0.37
TBXA2R P21731 1/20 0.37
SLC6A2 P23975 1/20 0.37
PDE4A P27815 1/20 0.37
ADRA1A P35348 1/20 0.37
KDR P35968 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
SCHEMBL9645164 0.83 CYP3A4 (0.44) CA1CA2CA9LMNAMAOB
SCHEMBL18071075 0.83 CA1 (0.46) CA1CA2CA9LMNAMAOB
SCHEMBL534724 0.82 GAA (0.54) CA1CA2CA9LMNATDP1
SCHEMBL29516284 0.82 GAA (0.54) CA1CA2CA9LMNATDP1
SCHEMBL10922221 0.77 GAA (0.48) CA1CA2CA9LMNATDP1
SCHEMBL18068781 0.75 NPC1 (0.42) CA1CA2CA9LMNAMAOB
SCHEMBL551122 0.74 TDP1 (0.56) CA1CA2CA9LMNAMAOB
SCHEMBL9116912 0.74 LMNA (0.55) CA1CA2CA9LMNAMAOB
SCHEMBL3283108 0.74 CA1 (0.47) CA1CA2CA9LMNATDP1
SCHEMBL11319350 0.73 TDP1 (0.44) CA1CA2CA9LMNATDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0739393-A1 PROCESS FOR PRODUCING ANTICORROSIVE PRIMING AND/OR FILLING LAYERS BASF Lacke + Farben AG (DE) 1996-10-30 EP disclosed
EP-0720637-A1 PROCESS FOR PRODUCING COATING LACQUER LAYERS BASF Lacke + Farben AG (DE) 1996-07-10 EP disclosed
WO-1995008599-A1 PROCESS FOR PRODUCING COATING LACQUER LAYERS BASF LACKE + FARBEN AG (DE) 1995-03-30 WO disclosed
WO-1995001405-A1 PROCESS FOR PRODUCING ANTICORROSIVE PRIMING AND/OR FILLING LAYERS BASF LACKE + FARBEN AG (DE) 1995-01-12 WO disclosed