SCHEMBL19971401

SCHEMBL19971401

CNC(=O)OCc1cn(S(=O)(=O)c2cccc(F)c2)c2cc(Nc3ccc(C)cc3F)ccc12

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 4/20 0.39
IDE P14735 1/20 0.37
PPARG P37231 7/20 0.35
PPARD Q03181 7/20 0.35
PPARA Q07869 6/20 0.35
RORC P51449 2/20 0.34
ALK Q9UM73 1/20 0.34
PTGDR Q13258 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
FBP1 P09467 1/20 0.34
MAPK14 Q16539 1/20 0.33

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
SCHEMBL19971358 0.93 ALK (0.39) HTR6ALK
SCHEMBL19971356 0.88 IDE (0.37) IDEALKHDAC1HDAC6FBP1
SCHEMBL19971361 0.87 HTR6 (0.36) HTR6IDEPPARGPPARDPPARA
SCHEMBL16626508 0.86 HTR6 (0.43) HTR6IDEPPARGPPARDPPARA
Hydrochloric Acid SCHEMBL16619225 0.85 HTR6 (0.42) HTR6IDEPPARGPPARDPPARA
SCHEMBL16619159 0.84 HDAC1 (0.41) HTR6IDEPPARGPPARDPPARA
SCHEMBL16626507 0.82 HDAC1 (0.38) HTR6IDERORCHDAC1HDAC2
SCHEMBL19971533 0.81 HTR6 (0.39) HTR6IDEPPARGRORCALK
SCHEMBL16626514 0.81 HTR6 (0.38) HTR6PPARGPPARDPPARAALK
Hydrochloric Acid SCHEMBL16618685 0.80 HTR6 (0.37) HTR6PPARGPPARDPPARAALK

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 disclosed