SCHEMBL7420132

SCHEMBL7420132

CCOc1ccc(S(=O)(=O)N(Cc2cccnc2)S(=O)(=O)CCN2C(=O)c3ccccc3C2=O)cc1OCC

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 6/20 0.52
PDE4B Q07343 6/20 0.52
PDE4C Q08493 6/20 0.52
PDE4D Q08499 6/20 0.52
KMT2A Q03164 4/20 0.45
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
BRD4 O60885 2/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ADAMTS4 O75173 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
PKM P14618 1/20 0.38
HPGD P15428 1/20 0.38
ALOX12 P18054 1/20 0.38
LMNA P02545 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
SCHEMBL7420778 0.89 PDE4A (0.65) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL7425366 0.78 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7418296 0.71 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL7423718 0.71 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7424242 0.70 PDE4A (0.72) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7414911 0.69 PDE4A (0.78) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL7420830 0.69 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL7598376 0.69 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7425188 0.67 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL6726569 0.67 MMP9 (0.67) ALDH1A1ADAMTS4

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-1996036595-A1 3,4-DISUBSTITUTED-PHENYLSULPHONAMIDES AND THEIR THERAPEUTIC USE CHIROSCIENCE LIMITED (GB) 1996-11-21 WO claimed