SCHEMBL19971348

SCHEMBL19971348

CNC(=O)OCc1cn(S(=O)(=O)c2cccc(F)c2)c2cc(Nc3ccc(C)cc3Cl)ncc12

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.36
PDE4A P27815 2/20 0.36
PDE4B Q07343 2/20 0.36
PDE4C Q08493 2/20 0.36
PDE4D Q08499 2/20 0.36
TP53 P04637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
DRD2 P14416 1/20 0.34
IDE P14735 1/20 0.33
PPARG P37231 3/20 0.33
PPARD Q03181 3/20 0.33
PPARA Q07869 3/20 0.33
RORC P51449 4/20 0.32
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HTR2A P28223 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
SCHEMBL16626797 0.87 HTR6 (0.39) HTR6PDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL16619085 0.86 HTR6 (0.38) HTR6PDE4APDE4BPDE4CPDE4D
SCHEMBL16619373 0.84 PDE4A (0.36) HTR6PDE4APDE4BPDE4CPDE4D
SCHEMBL16626798 0.82 TTK (0.39) HTR6PDE4APDE4BPDE4CPDE4D
SCHEMBL16626668 0.81 HTR6 (0.40) HTR6DRD2IDERORC
SCHEMBL19971353 0.81 HTR6 (0.41) HTR6DRD2IDERORCHTR2A
SCHEMBL19971533 0.81 HTR6 (0.39) HTR6PDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL16618810 0.81 HTR6 (0.41) HTR6DRD2IDERORCHTR2A
SCHEMBL19971401 0.79 HTR6 (0.39) HTR6IDEPPARGPPARDPPARA
SCHEMBL19971361 0.78 HTR6 (0.36) HTR6DRD2IDEPPARGPPARD

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