SCHEMBL28023637

SCHEMBL28023637

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.51
PSIP1 O75475 1/20 0.44
MMP1 P03956 3/20 0.42
MMP7 P09237 3/20 0.42
MMP12 P39900 3/20 0.42
MMP13 P45452 3/20 0.42
ACE P12821 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
CCR5 P51681 1/20 0.41
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
DUSP3 P51452 1/20 0.36
PTPN5 P54829 1/20 0.36
PTPN11 Q06124 1/20 0.36
ATM Q13315 1/20 0.36
HTR6 P50406 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
SCHEMBL28023032 0.85 PSIP1 (0.47) SMN1; SMN2PSIP1MMP1MMP7MMP12
SCHEMBL12370397 0.79 SMN1; SMN2 (0.56) SMN1; SMN2PSIP1MMP1MMP7MMP12
SCHEMBL28820920 0.77 MMP1 (0.54) SMN1; SMN2PSIP1MMP1MMP7MMP12
SCHEMBL28023647 0.77 MAPT (0.46) SMN1; SMN2TDP1ALDH1A1HSD11B1
SCHEMBL3917298 0.74 SMN1; SMN2 (0.50) SMN1; SMN2PSIP1MMP1MMP7MMP12
SCHEMBL2448076 0.74 MMP1 (0.51) SMN1; SMN2PSIP1MMP1MMP7MMP12
SCHEMBL28023657 0.74 SMN1; SMN2 (0.50) SMN1; SMN2PSIP1MMP1MMP7MMP12
SCHEMBL28604397 0.74 SMN1; SMN2 (0.50) SMN1; SMN2PSIP1MMP1MMP7MMP12
SCHEMBL11566604 0.74 SMN1; SMN2 (0.50) SMN1; SMN2PSIP1MMP1MMP7MMP12
SCHEMBL28023019 0.74 SMN1; SMN2 (0.50) SMN1; SMN2PSIP1MMP1MMP7MMP12

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