SCHEMBL22693012

SCHEMBL22693012

CC(C)Oc1ccc(C2(c3ccc(Oc4ccc(S(=O)(=O)c5ccc(OC(C)(C)c6ccc(C7(c8ccc(O)cc8)c8ccccc8-c8ccccc87)cc6)cc5)cc4)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.36
PDK2 Q15119 1/20 0.35
GAA P10253 1/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHRM5 P08912 2/20 0.33
MMP14 P50281 4/20 0.32
MMP1 P03956 3/20 0.32
MMP13 P45452 3/20 0.32
MMP2 P08253 3/20 0.32
MMP9 P14780 3/20 0.32
MMP3 P08254 2/20 0.32
PNLIP P16233 1/20 0.32
NAMPT P43490 2/20 0.32
HSD11B1 P28845 1/20 0.30
PTPN5 P54829 1/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
HSP90AA1 P07900 1/20 0.30

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
SCHEMBL25529698 0.83 ELANE (0.44) ELANEGAAPKMHTTSMN1; SMN2
SCHEMBL10066824 0.83 MMP2 (0.36) PDK2HTTSMN1; SMN2CHRM5MMP14
SCHEMBL13663837 0.76 HSD11B1 (0.41) PKMHTTSMN1; SMN2MMP14MMP1
SCHEMBL16418026 0.75 ELANE (0.51) ELANEGAAPKMHTTSMN1; SMN2
SCHEMBL20169354 0.74 ELANE (0.50) ELANEGAAPKMHTTSMN1; SMN2
SCHEMBL8776944 0.74 ESR2 (0.54) ELANEGAAPKMHTTSMN1; SMN2
SCHEMBL21840510 0.73 HTT (0.51) PDK2HTTSMN1; SMN2MMP14MMP1
SCHEMBL12113482 0.73 CNR2 (0.36) HTTSMN1; SMN2CHRM5
SCHEMBL822949 0.73 HTT (0.63) GAAPKMHTTSMN1; SMN2ESR1
SCHEMBL13638342 0.72 ELANE (0.41) ELANEGAAPKMHTTSMN1; SMN2

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-11444305-B2 Polymer electrolyte membrane, method for manufacturing same, and membrane electrode assembly comprising same KOLON INDUSTRIES, INC. (KR) 2022-09-13 US disclosed
US-10847827-B2 Ion conductor, method for preparing same, and ion-exchange membrane, membrane-electrode assembly and fuel cell comprising same KOLON INDUSTRIES, INC. (KR) 2020-11-24 US disclosed