SCHEMBL19320326

SCHEMBL19320326

COC(=O)Oc1ccccc1-c1ccccc1OC(=O)OCC(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40
UGCG Q16739 1/20 0.38
ALDH1A1 P00352 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
AR P10275 1/20 0.38
ELANE P08246 1/20 0.37
MAPT P10636 2/20 0.37
FABP7 O15540 1/20 0.37
CETP P11597 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
HTT P42858 2/20 0.36
LMNA P02545 2/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
MEN1 O00255 1/20 0.36
S1PR2 O95136 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
SCHEMBL19320324 0.92 FABP7 (0.41) KDM4EHPGDHSD17B10AKR1C3AKR1C2
SCHEMBL17720752 0.84 TDP1 (0.44) KDM4EUGCGALDH1A1L3MBTL1AR
SCHEMBL6254697 0.82 KDM4E (0.63) KDM4EHPGDHSD17B10ALDH1A1L3MBTL1
SCHEMBL19320325 0.81 HPGD (0.51) KDM4EHPGDHSD17B10ALDH1A1ELANE
SCHEMBL19320323 0.81 KDM4E (0.47) KDM4EHPGDHSD17B10ALDH1A1L3MBTL1
SCHEMBL17451426 0.74 KDM4E (0.54) KDM4EHPGDHSD17B10AKR1C3AKR1C2
SCHEMBL15454362 0.74 HPGD (0.54) KDM4EHPGDHSD17B10AKR1C3AKR1C2
SCHEMBL1960366 0.74 TYMS (0.51) ALDH1A1L3MBTL1ELANEMAPTLMNA
SCHEMBL1436536 0.73 PTPN5 (0.55) KDM4EHPGDHSD17B10AKR1C3AKR1C2
SCHEMBL19320329 0.73 ELANE (0.38) KDM4EHPGDHSD17B10ALDH1A1ELANE

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-20170256819-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND ENERGY STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD. (JP) 2017-09-07 US disclosed
US-20170256819-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND ENERGY STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD. (JP) 2017-09-07 US disclosed