SCHEMBL19971426

SCHEMBL19971426

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

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.45
HTR6 P50406 10/20 0.39
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
BRD4 O60885 1/20 0.36
FBP1 P09467 2/20 0.35
KDM2B Q8NHM5 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL19971445 0.81 RORC (0.48) RORCHTR6BRD4FBP1
SCHEMBL16618633 0.81 RORC (0.47) RORCHTR6HDAC1HDAC2HDAC6
SCHEMBL19971362 0.81 RORC (0.48) RORCBRD4
SCHEMBL16626634 0.78 RORC (0.45) RORCHTR6HDAC1HDAC2HDAC6
SCHEMBL19971353 0.74 HTR6 (0.41) RORCHTR6HDAC1HDAC2HDAC6
SCHEMBL19971366 0.73 HTR6 (0.41) HTR6BRD4
SCHEMBL19971533 0.72 HTR6 (0.39) RORCHTR6MEN1KMT2AL3MBTL1
SCHEMBL19971346 0.72 IDE (0.41) HTR6HDAC1MEN1KMT2A
SCHEMBL2415052 0.71 MEP1B (0.43) HTR6HDAC1ALDH1A1KMT2AL3MBTL1
SCHEMBL19971354 0.71 HTR6 (0.38) HTR6ALDH1A1POLB

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