SCHEMBL19320324

SCHEMBL19320324

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP7 O15540 1/20 0.41
ELANE P08246 2/20 0.38
HTT P42858 2/20 0.37
MEN1 O00255 1/20 0.37
S1PR2 O95136 1/20 0.37
S1PR4 O95977 1/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
XBP1 P17861 1/20 0.37
KMT2A Q03164 1/20 0.37
PAX8 Q06710 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
S1PR3 Q99500 1/20 0.37
S1PR5 Q9H228 1/20 0.37
UGCG Q16739 1/20 0.37
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PTGDR2 Q9Y5Y4 2/20 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
SCHEMBL19320326 0.92 KDM4E (0.46) FABP7ELANEHTTMEN1S1PR2
SCHEMBL17720752 0.91 TDP1 (0.44) FABP7HTTLMNAGAASMN1; SMN2
SCHEMBL321643 0.79 FABP7 (0.46) FABP7ELANEHTTMEN1S1PR2
SCHEMBL17720722 0.78 FABP7 (0.40) FABP7ELANEKMT2AALDH1A1L3MBTL1
SCHEMBL1960366 0.77 TYMS (0.51) ELANEMEN1LMNAMAPTKMT2A
SCHEMBL19320329 0.76 ELANE (0.38) FABP7ELANEHTTMEN1LMNA
SCHEMBL27994489 0.71 KDM4E (0.46) HTTMEN1S1PR2S1PR4LMNA
SCHEMBL19320325 0.71 HPGD (0.51) ELANEMEN1LMNAGAAMAPT
SCHEMBL16236877 0.71 TYMS (0.50) ELANELMNAGAASMN1; SMN2ALDH1A1
SCHEMBL17698892 0.71 GLA (0.52) ELANEMEN1LMNAGAAMAPT

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