SCHEMBL3964674

SCHEMBL3964674

O=Cc1cccn1S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPME1 Q9Y570 7/20 0.58
RAPGEF4 Q8WZA2 2/20 0.56
PKM P14618 2/20 0.46
ALDH3A1 P30838 1/20 0.44
ALDH1A1 P00352 2/20 0.43
APEH P13798 1/20 0.42
MMP2 P08253 1/20 0.41
ACHE P22303 1/20 0.41
PSEN1 P49768 1/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 1/20 0.41
CYP3A4 P08684 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL1616366 0.84 PPME1 (0.60) PPME1ALDH1A1APEHKMT2A
SCHEMBL2457308 0.83 RAPGEF4 (0.58) PPME1RAPGEF4PKMALDH3A1ALDH1A1
SCHEMBL3968075 0.83 PPME1 (0.55) PPME1RAPGEF4PKMALDH3A1APEH
SCHEMBL3964676 0.83 PPME1 (0.45) PPME1RAPGEF4APEHCYP3A4
SCHEMBL3966831 0.83 MET (0.49) PPME1PKMALDH1A1MMP2CYP3A4
SCHEMBL3967048 0.80 PPME1 (0.43) PPME1RAPGEF4ALDH1A1APEH
SCHEMBL3969097 0.76 NOD1 (0.43) PPME1RAPGEF4APEHMMP2ACHE
SCHEMBL3968076 0.75 MET (0.47) PPME1RAPGEF4ALDH1A1CYP3A4KMT2A
SCHEMBL16653247 0.72 RAPGEF4 (1.00) PPME1RAPGEF4PKMALDH3A1ALDH1A1
SCHEMBL5247297 0.71 RAPGEF4 (0.60) PPME1RAPGEF4ALDH1A1APEHKMT2A

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-2009044147-A1 INDOLIZINE DERIVATIVES WITH CRTH2 RECEPTOR AFFINITY FOR THE TREATMENT OF INFLAMMATORY DISEASES ARGENTA DISCOVERY LIMITED (GB) 2009-04-09 WO disclosed