SCHEMBL16626370

SCHEMBL16626370

CNCc1cn([S+]([O-])c2cccnc2)c2cc(Nc3ccccc3Cl)ccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 3/20 0.35
MAPK10 P53779 3/20 0.35
MAPK14 Q16539 3/20 0.35
HTR2C P28335 1/20 0.33
NAMPT P43490 1/20 0.31
BCL6 P41182 2/20 0.31
HTT P42858 1/20 0.31
BCOR Q6W2J9 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NFKB1 P19838 1/20 0.31
RAB9A P51151 1/20 0.31
NFKB2 Q00653 1/20 0.31
KMT2A Q03164 1/20 0.31
RELA Q04206 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ROCK2 O75116 1/20 0.30
PTGS1 P23219 1/20 0.30
PTGS2 P35354 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
SCHEMBL16626715 0.89 GRM4 (0.33) MAPK10HTR2CBCL6
SCHEMBL16626457 0.88 PARP14 (0.33)
SCHEMBL19984086 0.88 EGFR (0.34) MAPK14HTR2C
SCHEMBL19984214 0.87 MEN1 (0.32) HTR2CNAMPTMEN1ALDH1A1KMT2A
SCHEMBL16626401 0.87 SLC6A2 (0.37) NAMPTALDH1A1RAB9ASMN1; SMN2
SCHEMBL16626484 0.87 BCL6 (0.36) BCL6
SCHEMBL16626476 0.87
SCHEMBL16626468 0.87 METAP2 (0.30)
SCHEMBL16626453 0.86
SCHEMBL16626461 0.85 BCL6 (0.33) BCL6

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