SCHEMBL5531006

SCHEMBL5531006

Cc1ccc(S(=O)(=O)c2cnc3[nH]ccc3c2Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 1/20 0.54
PRKCI P41743 1/20 0.54
GRM5 P41594 3/20 0.47
HTR1A P08908 2/20 0.43
HTR2A P28223 2/20 0.43
HTR7 P34969 2/20 0.43
HTR6 P50406 2/20 0.43
POLB P06746 3/20 0.41
DUSP3 P51452 1/20 0.41
PTPN5 P54829 1/20 0.41
PTPN11 Q06124 1/20 0.41
COMT P21964 2/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 3/20 0.39
TP53 P04637 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38

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
SCHEMBL17113647 0.86 MET (0.49) AXLPRKCIGRM5HTR1AHTR2A
SCHEMBL16493719 0.82 MAPT (0.43) AXLPRKCIGRM5POLBGAA
SCHEMBL7032135 0.81 GRM5 (0.41) AXLPRKCIGRM5POLBCOMT
SCHEMBL28111978 0.79 IKBKB (0.48) AXLPRKCICOMTGAAMEN1
SCHEMBL1346311 0.76 GRM5 (0.70) GRM5HTR1AHTR2AHTR7HTR6
SCHEMBL4307074 0.76 GRM5 (0.35) AXLPRKCIGRM5POLBCOMT
SCHEMBL15543131 0.76 PRKCI (0.40) AXLPRKCICOMTGAAMAPT
SCHEMBL27969602 0.73 IKBKB (0.49) GAAMAPTMEN1KMT2AJAK2
SCHEMBL28609163 0.73 AXL (0.61) AXLPRKCIJAK2IKBKBCHUK
SCHEMBL30173316 0.73 AXL (0.61) AXLPRKCIJAK2IKBKBCHUK

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-1799691-A1 NOVEL BIS-AZAINDOLE DERIVATIVES, PREPARATION AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS Aventis Pharma S.A. (FR) 2007-06-27 EP disclosed
WO-2006037875-A1 NOVEL BIS-AZAINDOLE DERIVATIVES, PREPARATION AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2006-04-13 WO disclosed