SCHEMBL19971345

SCHEMBL19971345

NC(=O)OCCc1cn(S(=O)(=O)c2cccnc2)c2cc(O)ccc12

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDE P14735 4/20 0.43
HTR6 P50406 15/20 0.42
DRD2 P14416 2/20 0.38
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
HTR1A P08908 1/20 0.35
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
HTR1F P30939 1/20 0.35
HTR7 P34969 1/20 0.35
DRD3 P35462 1/20 0.35

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
SCHEMBL28207563 0.89 IDE (0.42) IDEHTR6DRD2HTR1AHTR1D
SCHEMBL28857516 0.88 IDE (0.41) IDEHTR6DRD2HTR1AHTR1D
SCHEMBL19971398 0.81 PDE4A (0.40) IDEHTR6DRD2PDE4APDE4B
SCHEMBL19971346 0.81 IDE (0.41) IDEHTR6PDE4APDE4BPDE4C
SCHEMBL19984047 0.79 HTR6 (0.43) IDEHTR6DRD2PDE4APDE4B
SCHEMBL28068083 0.79 IDE (0.43) IDEHTR6PDE4APDE4BPDE4C
SCHEMBL19971450 0.78 POLB (0.36) IDEHTR6
SCHEMBL16619076 0.78 HTR6 (0.47) IDEHTR6DRD2PDE4APDE4B
SCHEMBL4772155 0.77 HTR6 (0.47) HTR6DRD2HTR1AHTR1DHTR1B
SCHEMBL28068094 0.76 NAPRT (0.40) IDEHTR6PDE4APDE4BPDE4C

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-3052484-B1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAE WOONG PHARMA (KR) 2018-03-21 EP claimed