SCHEMBL16430643

SCHEMBL16430643

COc1ccc(S(=O)(=O)Nc2cccc(C(=O)Nc3ccccc3C(N)=O)c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.67
KMT2A Q03164 4/20 0.67
TCF4 P15884 1/20 0.62
CTNNB1 P35222 1/20 0.62
EGFR P00533 3/20 0.56
FGFR1 P11362 3/20 0.56
KDR P35968 3/20 0.56
CYP19A1 P11511 1/20 0.56
NPC1 O15118 1/20 0.55
MAPT P10636 2/20 0.53
PKM P14618 1/20 0.53
CA2 P00918 1/20 0.52
SIRT2 Q8IXJ6 1/20 0.52
HDAC3 O15379 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC2 Q92769 1/20 0.52
NCOR2 Q9Y618 1/20 0.52
ALDH1A1 P00352 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51

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
SCHEMBL16430718 0.87 ALDH1A1 (0.56) MEN1KMT2ATCF4CTNNB1EGFR
SCHEMBL16430504 0.86 TCF4 (0.69) MEN1KMT2ATCF4CTNNB1EGFR
SCHEMBL16431446 0.85 TCF4 (0.65) MEN1KMT2ATCF4CTNNB1EGFR
SCHEMBL16430653 0.85 TCF4 (0.54) MEN1KMT2ATCF4CTNNB1EGFR
SCHEMBL16430707 0.85 TCF4 (0.54) MEN1KMT2ATCF4CTNNB1EGFR
SCHEMBL16430148 0.84 TCF4 (0.66) MEN1KMT2ATCF4CTNNB1EGFR
SCHEMBL16430799 0.84 TCF4 (0.52) MEN1KMT2ATCF4CTNNB1EGFR
SCHEMBL16430813 0.82 TCF4 (0.66) MEN1KMT2ATCF4CTNNB1EGFR
SCHEMBL29978644 0.82 MEN1 (0.71) MEN1KMT2AMAPTPKMSIRT2
SCHEMBL665214 0.82 MEN1 (0.71) MEN1KMT2AMAPTPKMSIRT2

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
WO-2015016293-A1 (BENZENESULFONYLAMINO)BENZAMIDE DERIVATIVE, AND SHIP2 INHIBITOR CONTAINING SAME AS ACTIVE INGREDIENT 国立大学法人 富山大学 (JP) 2015-02-05 WO disclosed