SCHEMBL5405748

SCHEMBL5405748

CCCCCCCCC1(CCCCCCCC)c2cc(OB(O)O)ccc2-c2ccc(OB(O)O)cc21

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.41
MMP2 P08253 3/20 0.36
MMP9 P14780 3/20 0.36
MMP8 P22894 3/20 0.36
MMP13 P45452 3/20 0.36
NR5A1 Q13285 1/20 0.34
PTPN11 Q06124 2/20 0.33
CNR1 P21554 2/20 0.33
CNR2 P34972 2/20 0.33
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL31337101 0.94 PDK2 (0.48) PDK2PTPN11
SCHEMBL30800037 0.94 PDK2 (0.48) PDK2PTPN11
SCHEMBL5557773 0.94 PDK2 (0.48) PDK2PTPN11
SCHEMBL5555741 0.92 PDK2 (0.47) PDK2PTPN11
SCHEMBL1494267 0.88 PDK2 (0.37) PDK2MMP2MMP9MMP8MMP13
SCHEMBL5555701 0.88 PDK2 (0.47) PDK2
SCHEMBL14990355 0.84 MMP2 (0.39) PDK2MMP2MMP9MMP8MMP13
SCHEMBL3792892 0.79 PDK2 (0.33) PDK2
SCHEMBL374243 0.78 LIPG (0.46) PDK2MMP2MMP9MMP8MMP13
SCHEMBL371497 0.78 LIPG (0.46) PDK2MMP2MMP9MMP8MMP13

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
US-7258932-B2 Polymeric fluorescent substrate and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-08-21 US disclosed
US-20030068527-A1 Polymeric fluorescent substrate and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2003-04-10 US disclosed