SCHEMBL20550796

SCHEMBL20550796

Cc1ccc(S(=O)(=O)C(C(N)=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
LMNA P02545 3/20 0.47
RXFP1 Q9HBX9 1/20 0.47
KDM4E B2RXH2 1/20 0.46
MAPT P10636 4/20 0.45
KMT2A Q03164 2/20 0.45
HTT P42858 1/20 0.45
EGFR P00533 1/20 0.43
ERBB2 P04626 1/20 0.43
TP53 P04637 1/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
RECQL P46063 1/20 0.43
NPC1 O15118 1/20 0.42
UTS2R Q9UKP6 1/20 0.42
CNR2 P34972 1/20 0.41
POLB P06746 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL7096179 0.84 KMT2A (0.44) ALDH1A1LMNAKMT2AEGFRERBB2
SCHEMBL4801052 0.84 ALDH1A1 (0.42) ALDH1A1LMNAMAPTKMT2ANPC1
SCHEMBL4798350 0.84 KMT2A (0.44) ALDH1A1KDM4EKMT2AEGFRERBB2
SCHEMBL4983476 0.84 CYP2D6 (0.51) ALDH1A1LMNAMAPTHTTRECQL
SCHEMBL30716686 0.83 MEN1 (0.44) ALDH1A1LMNAMAPTKMT2AHTT
SCHEMBL19716790 0.77 ENPP3 (0.43) ALDH1A1LMNAKDM4EMAPTKMT2A
SCHEMBL19716788 0.77 ENPP3 (0.43) ALDH1A1LMNAKDM4EMAPTKMT2A
SCHEMBL11218064 0.76 SRC (0.47) ALDH1A1LMNAMAPK1GAA
SCHEMBL11212883 0.76 SRC (0.47) ALDH1A1LMNAMAPTKMT2AHTT
SCHEMBL11812541 0.75 LMNA (0.54) ALDH1A1LMNARXFP1KDM4EMAPT

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-3619204-A1 COMPOUNDS FOR THE TREATMENT OF RESPIRATORY DISEASES The University of Melbourne (AU) 2020-03-11 EP disclosed
WO-2018201192-A1 COMPOUNDS FOR THE TREATMENT OF RESPIRATORY DISEASES THE UNIVERSITY OF MELBOURNE (AU) 2018-11-08 WO disclosed