SCHEMBL576360

SCHEMBL576360

Fc1c(F)c(F)c(C(SSC(c2ccccc2)c2c(F)c(F)c(F)c(F)c2F)c2ccccc2)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
SLC6A3 Q01959 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
SLC6A4 P31645 1/20 0.38
CYP2C19 P33261 1/20 0.38
DPP4 P27487 2/20 0.33
F2 P00734 1/20 0.33
HTR2A P28223 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
MAPK1 P28482 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
SRC P12931 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
SCHEMBL575711 0.86 TSHR (0.38) TSHRSLC6A3CYP2D6CYP1A2CYP3A4
SCHEMBL775058 0.77 TSHR (0.48) TSHRSLC6A3CYP2D6CYP1A2CYP3A4
SCHEMBL3882388 0.74 SLC6A3 (0.42) TSHRSLC6A3CYP2D6CYP1A2CYP3A4
SCHEMBL575898 0.71 IDO1 (0.48) TSHRSLC6A3CYP2D6CYP1A2CYP3A4
SCHEMBL15388309 0.70 CES2 (0.38) TSHRCYP2D6DPP4F2HTR2A
SCHEMBL5873438 0.70 SMN1; SMN2 (0.42) TSHRCYP2C9HPGDALOX15MAPK1
SCHEMBL576436 0.70 IDO1 (0.50) SLC6A4
SCHEMBL30812281 0.67 GAA (0.39) TSHRSLC6A3CYP2C9SLC6A4CYP2C19
SCHEMBL776890 0.66 TSHR (0.48) TSHRSLC6A3CYP2D6CYP1A2CYP3A4
SCHEMBL31380288 0.65 TDP1 (0.47) CYP2D6MAPK1SRC

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