SCHEMBL14767718

SCHEMBL14767718

COc1cc2c(cc1O)NS(=O)(=O)N=C2N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.39
MAOA P21397 3/20 0.38
ACHE P22303 2/20 0.35
CA1 P00915 2/20 0.32
CA2 P00918 1/20 0.32
CLK1 P49759 1/20 0.32
CLK2 P49760 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
PTGS2 P35354 1/20 0.32
MITF O75030 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
GAA P10253 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SLC22A6 Q4U2R8 1/20 0.31

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
SCHEMBL14818106 0.94 MAOA (0.38) EGFRMAOAACHECA1CA2
SCHEMBL2417713 0.88 CYP3A4 (0.33) MAOACA1CA2ALDH1A1MAPT
SCHEMBL12322167 0.66 TGM2 (0.40) CA1CA2MAPTMEN1KMT2A
SCHEMBL4400137 0.62 MAOB (0.50) MAOAACHECA1CA2PTGS2
SCHEMBL19437875 0.61 ACHE (0.53) EGFRACHECA1CA2ALDH1A1
SCHEMBL69624 0.61 MAOB (0.59) CA1CA2ALDH1A1LMNATP53
SCHEMBL13008679 0.60 KDM4E (0.50) CA2ALDH1A1LMNAMAPTTSHR
SCHEMBL24285723 0.60 ACHE (0.47) EGFRACHECA1CA2ALDH1A1
SCHEMBL1599771 0.59 GAA (0.56) CA2ALDH1A1LMNAMAPTTSHR
SCHEMBL11702085 0.59 PKM (0.53) CA2ALDH1A1LMNAMAPTTSHR

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-2573559-A1 Modulation of chemosensory receptors and ligands associated Senomyx, Inc. (US) 2013-03-27 EP disclosed
EP-2568287-A2 Modulation of chemosensory receptors and ligands associated Senomyx, Inc. (US) 2013-03-13 EP disclosed