SCHEMBL15438129

SCHEMBL15438129

COP(=O)(CC(=O)Oc1cc(C(F)(F)F)cc(C(F)(F)F)c1)OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.37
RXRB P28702 2/20 0.37
RXRG P48443 2/20 0.37
CES2 O00748 1/20 0.37
TMPRSS4 Q9NRS4 3/20 0.36
P2RX1 P51575 2/20 0.36
NOTUM Q6P988 1/20 0.35
SCN9A Q15858 3/20 0.34
MAPT P10636 3/20 0.34
KDM4E B2RXH2 2/20 0.34
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
GPR35 Q9HC97 1/20 0.33
LMNA P02545 1/20 0.33
SOD1 P00441 1/20 0.33
ADCY8 P40145 1/20 0.33
ADCY1 Q08828 1/20 0.33
TLR8 Q9NR97 1/20 0.33

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
SCHEMBL15438463 0.86 KDM4E (0.48) MAPTKDM4ELMNA
SCHEMBL15438072 0.85 RXRA (0.37) RXRARXRBRXRGCES2TMPRSS4
SCHEMBL15438643 0.85 KIF11 (0.46) MAPTKDM4ELMNA
SCHEMBL15438156 0.85 ALDH1A1 (0.31) MAPTLMNA
SCHEMBL17356500 0.78 SCN9A (0.37) RXRARXRBRXRGSCN9AGPR35
SCHEMBL2191360 0.77 ESR1 (0.44) RXRARXRBRXRGCES2NOTUM
SCHEMBL15765770 0.77 CES2 (0.47) RXRARXRBRXRGCES2P2RX1
SCHEMBL17352120 0.76 HTR2A (0.39)
SCHEMBL15438765 0.76 RXRA (0.44) RXRARXRBRXRGCES2MAPT
SCHEMBL15475154 0.74 ACHE (0.37) MAPTKDM4ELMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2698859-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND ELECTRICITY-STORAGE DEVICE USING THE SAME UBE INDUSTRIES (JP) 2016-07-27 EP disclosed
US-9384906-B2 Non-aqueous electrolyte solution and electricity-storage device using same UBE INDUSTRIES, LTD. (JP) 2016-07-05 US disclosed
EP-2698859-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY-STORAGE DEVICE USING SAME Ube Industries, Ltd. (JP) 2014-02-19 EP disclosed
US-20140030610-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY-STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD (JP) 2014-01-30 US disclosed