SCHEMBL16626693

SCHEMBL16626693

CNCc1cn([S+]([O-])c2cccnc2)c2cc(Nc3cc(F)ccc3F)ccc12

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
PABPC1 P11940 1/20 0.30
KMT2A Q03164 1/20 0.30
TGFBR1 P36897 1/20 0.30
NTRK1 P04629 1/20 0.30
EGFR P00533 1/20 0.30
NAMPT P43490 1/20 0.30

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
SCHEMBL16626424 0.93 MAPK14 (0.36) TBXAS1ALDH1A1MAPTNAMPT
SCHEMBL19984136 0.89 MEN1 (0.39) MEN1MAPTPABPC1KMT2AEGFR
SCHEMBL16626468 0.87 METAP2 (0.30)
SCHEMBL16626433 0.87 EGFR (0.33) EGFR
SCHEMBL16626477 0.85
SCHEMBL19983986 0.85 ALDH1A1 (0.31) TBXAS1ALDH1A1EGFR
SCHEMBL16626457 0.85 PARP14 (0.33)
SCHEMBL19983881 0.85
SCHEMBL16626370 0.84 MAPK8 (0.35) ALDH1A1MEN1KMT2ANAMPT
SCHEMBL19983811 0.84

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 disclosed
WO-2015050412-A1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2015-04-09 WO disclosed