SCHEMBL28023032

SCHEMBL28023032

CCC(N(C)C)S(=O)(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.47
CCR5 P51681 1/20 0.46
TDP1 Q9NUW8 1/20 0.41
DUSP3 P51452 1/20 0.39
PTPN5 P54829 1/20 0.39
PTPN11 Q06124 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HTR6 P50406 2/20 0.38
MMP1 P03956 3/20 0.38
MMP7 P09237 3/20 0.38
MMP12 P39900 3/20 0.38
MMP13 P45452 3/20 0.38
ACE P12821 2/20 0.38
HSD11B1 P28845 2/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 2/20 0.36
TP53 P04637 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL28023637 0.85 SMN1; SMN2 (0.51) PSIP1CCR5TDP1DUSP3PTPN5
SCHEMBL1330816 0.76 PSIP1 (0.50) PSIP1CCR5TDP1SMN1; SMN2HTR6
SCHEMBL13276428 0.75 PSIP1 (0.54) PSIP1CCR5TDP1DUSP3PTPN5
SCHEMBL2443658 0.75 PSIP1 (0.54) PSIP1CCR5TDP1DUSP3PTPN5
SCHEMBL28023636 0.74 KDM4E (0.43) PSIP1CCR5TDP1DUSP3PTPN5
SCHEMBL2446838 0.74 PSIP1 (0.52) PSIP1CCR5TDP1SMN1; SMN2HTR6
SCHEMBL28215832 0.73 KEAP1 (0.46) CCR5ALDH1A1
SCHEMBL3701827 0.72 PSIP1 (0.50) PSIP1CCR5TDP1DUSP3PTPN5
SCHEMBL28895074 0.72 PSIP1 (0.50) PSIP1CCR5TDP1SMN1; SMN2HTR6
SCHEMBL28023638 0.72 PSIP1 (0.50) PSIP1CCR5TDP1DUSP3PTPN5

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
CN-103509135-B Olefin polymerization catalyst component, preparation method and application thereof CHINA PETROLEUM & CHEMICAL 2015-07-22 CN disclosed