SCHEMBL28068094

SCHEMBL28068094

[CH2]c1cn(S(=O)(=O)c2cccnc2)c2cc(O)ccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.40
HTR6 P50406 4/20 0.38
KDM4E B2RXH2 1/20 0.38
IDE P14735 1/20 0.36
HPGD P15428 1/20 0.35
HDAC1 Q13547 2/20 0.35
CYP11B1 P15538 2/20 0.34
CYP11B2 P19099 2/20 0.34
CYP17A1 P05093 1/20 0.34
CYP3A4 P08684 1/20 0.34
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
CHRM1 P11229 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP19A1 P11511 1/20 0.33
HSP90AA1 P07900 1/20 0.32
CAPN1 P07384 1/20 0.32
TRPV4 Q9HBA0 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
SCHEMBL28068106 0.85 HTR6 (0.39) NAPRTHTR6KDM4EIDEHPGD
SCHEMBL28068088 0.82 HTR6 (0.36) NAPRTHTR6KDM4EIDEHPGD
SCHEMBL19984047 0.80 HTR6 (0.43) NAPRTHTR6IDEPDE4APDE4B
SCHEMBL16619076 0.77 HTR6 (0.47) HTR6IDEHDAC1PDE4APDE4B
SCHEMBL28068083 0.76 IDE (0.43) HTR6IDEPDE4APDE4BPDE4C
SCHEMBL19971346 0.76 IDE (0.41) HTR6IDEHDAC1PDE4APDE4B
SCHEMBL19971345 0.76 IDE (0.43) HTR6IDEPDE4APDE4BPDE4C
SCHEMBL16626645 0.72 HTR6 (0.41) HTR6IDEHDAC1PDE4APDE4B
SCHEMBL19971360 0.71 AKR1C3 (0.56) NAPRTHTR6KDM4EIDEHDAC1
SCHEMBL28658615 0.71 CYP17A1 (0.39) NAPRTKDM4EHPGDHDAC1CYP11B1

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
CN-105612150-A Sulfonylindole derivatives and process for producing the same DAE WOONG PHARMA 2016-05-25 CN disclosed