SCHEMBL10865751

SCHEMBL10865751

Cc1cc(C)nc(N(C(N)=NN(C)C)S(=O)(=O)c2ccccc2S(=O)(=O)N(C)C)n1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
SMN1; SMN2 Q16637 4/20 0.37
MAPT P10636 1/20 0.36
ALDH1A1 P00352 7/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
KCNJ6 P48051 1/20 0.33
KCNJ5 P48544 1/20 0.33
KCNJ3 P48549 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
MCL1 Q07820 1/20 0.32

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
SCHEMBL10498917 0.88 KDM4E (0.54) KDM4ESMN1; SMN2MAPTALDH1A1HTT
SCHEMBL10502876 0.83 CA1 (0.44) KDM4ESMN1; SMN2MAPTALDH1A1POLB
SCHEMBL10688914 0.82 HCRTR1 (0.43) KDM4ESMN1; SMN2
SCHEMBL9741957 0.81 SMN1; SMN2 (0.55) KDM4ESMN1; SMN2MAPTALDH1A1POLB
SCHEMBL10867034 0.80 SMN1; SMN2 (0.67) KDM4ESMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL10865204 0.79 ALDH1A1 (0.41) KDM4ESMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL9474698 0.78 KDM4E (0.39) KDM4ESMN1; SMN2ALDH1A1POLBHTT
SCHEMBL9591445 0.78 KDM4E (0.58) KDM4ESMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL10920467 0.76 KMT2A (0.42) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL10866779 0.74 SMN1; SMN2 (0.41) KDM4ESMN1; SMN2MAPTALDH1A1POLB

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-0173319-A1 Substituted arylsulfonyl guanidines BAYER AG (DE) 1986-03-05 EP disclosed