SCHEMBL576436

SCHEMBL576436

Fc1cccc(C(SSC(c2ccccc2)c2cccc(F)c2)c2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.50
TDO2 P48775 2/20 0.50
EPHX1 P07099 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
CNR2 P34972 1/20 0.41
NFE2L2 Q16236 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
OPRL1 P41146 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
MTOR P42345 1/20 0.37
CYP19A1 P11511 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL576210 0.88 IDO1 (0.55) IDO1TDO2EPHX1HDAC4HDAC7
SCHEMBL29001727 0.87 EPHX1 (0.44) IDO1TDO2EPHX1HDAC4HDAC7
SCHEMBL3882388 0.80 SLC6A3 (0.42) IDO1TDO2EPHX1CNR2NFE2L2
SCHEMBL30452329 0.79 IDO1 (0.41) IDO1TDO2EPHX1HDAC4HDAC7
SCHEMBL775058 0.79 TSHR (0.48) SLC6A4MTOR
SCHEMBL27774105 0.73 HDAC4 (0.49) IDO1TDO2HDAC4HDAC7HDAC5
SCHEMBL576421 0.72 HDAC4 (0.43) IDO1TDO2EPHX1HDAC4HDAC7
SCHEMBL7519538 0.72 IDO1 (0.52) IDO1TDO2EPHX1HDAC4HDAC7
SCHEMBL12696930 0.72 IDO1 (0.56) IDO1TDO2EPHX1HDAC4HDAC7
SCHEMBL230487 0.72 IDO1 (0.52) IDO1TDO2EPHX1HDAC4HDAC7

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
US-20220278370-A1 NONAQUEOUS ELECTROLYTE FOR SECONDARY BATTERY AND NONAQUEOUS-ELECTROLYTE SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2022-09-01 US disclosed
EP-2418723-A1 Nonaqueous electrolyte for secondary battery and nonaqueous-electrolyte secondary battery employing the same Mitsubishi Chemical Corporation (JP) 2012-02-15 EP disclosed
EP-2378602-A2 Nonaqueous electrolyte for recherable battery, and recharchable battery with nonaqueous electrolyte Mitsubishi Chemical Corporation (JP) 2011-10-19 EP disclosed
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed