SCHEMBL19971369

SCHEMBL19971369

CNC(=O)OCc1cn(S(=O)(=O)c2cccc(C(F)(F)F)c2)c2cc(Nc3ccc(OC)nc3Cl)ccc12

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 11/20 0.39
SLC20A2 Q08357 1/20 0.37
SLC20A1 Q8WUM9 1/20 0.37
ALOX15 P16050 1/20 0.34
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
PPARG P37231 2/20 0.33
PIK3CA P42336 1/20 0.33
HTR6 P50406 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
EPHX2 P34913 1/20 0.32
CYSLTR1 Q9Y271 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
SCHEMBL16626748 0.88 RORC (0.38) RORCSLC20A2SLC20A1ALOX15MAPT
Hydrochloric Acid SCHEMBL16618931 0.88 RORC (0.38) RORCSLC20A2SLC20A1ALOX15MAPT
SCHEMBL16618751 0.86 SLC20A2 (0.43) RORCSLC20A2SLC20A1ALOX15NPC1
SCHEMBL16618638 0.86 HTR6 (0.42) RORCSLC20A2SLC20A1ALOX15MAPT
SCHEMBL16619006 0.86 RORC (0.40) RORCSLC20A2SLC20A1ALOX15NPC1
SCHEMBL16619379 0.85 RORC (0.37) RORCSLC20A2SLC20A1ALOX15MAPT
SCHEMBL19971355 0.85 RORC (0.38) RORCPPARGHTR6
SCHEMBL16619007 0.84 HTR6 (0.42) NPC1HTR6
SCHEMBL16626659 0.84 RORC (0.37) RORCSLC20A2SLC20A1CYP3A4CYP2D6
SCHEMBL16619023 0.83 HDAC1 (0.43) RORCSLC20A2SLC20A1ALOX15NPC1

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