SCHEMBL19971362

SCHEMBL19971362

CNC(=O)OCc1cn(S(=O)(=O)c2cccc(OC(F)F)c2)c2cc(-c3cccnc3C(F)(F)F)ccc12

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 11/20 0.48
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
BRD4 O60885 1/20 0.37
METAP2 P50579 3/20 0.36
SCN9A Q15858 1/20 0.35
SLC1A3 P43003 2/20 0.34
SLC1A2 P43004 2/20 0.34
SLC1A1 P43005 2/20 0.34
MET P08581 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
SCHEMBL16626632 0.89 RORC (0.49) RORCPDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL16619315 0.88 RORC (0.49) RORCPDE4APDE4BPDE4CPDE4D
SCHEMBL28068082 0.88 RORC (0.49) RORCPDE4APDE4BPDE4CPDE4D
SCHEMBL16618918 0.85 RORC (0.51) RORCPDE4APDE4BPDE4CPDE4D
SCHEMBL16626638 0.82 RORC (0.47) RORCPDE4APDE4BPDE4CPDE4D
SCHEMBL19971426 0.81 RORC (0.45) RORCBRD4
SCHEMBL17971568 0.74 METAP2 (0.41) RORCPDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL16618831 0.73 METAP2 (0.41) RORCMETAP2SCN9A
SCHEMBL17971573 0.72 RORC (0.51) RORCBRD4
Hydrochloric Acid SCHEMBL16619011 0.72 RORC (0.50) RORCBRD4

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