SCHEMBL4136100

SCHEMBL4136100

O=S(=O)(O)OC(F)(F)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA5A P35218 1/20 0.45
CA9 Q16790 1/20 0.45
PTPN1 P18031 5/20 0.43
TSHR P16473 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HSD11B1 P28845 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
HTR6 P50406 1/20 0.36
PGK1 P00558 1/20 0.35
PGK2 P07205 1/20 0.35
KCNN4 O15554 1/20 0.35
CYP1A2 P05177 1/20 0.34
ALOX15 P16050 1/20 0.34
CES1 P23141 1/20 0.34
PTPN5 P54829 2/20 0.34
NR1H2 P55055 1/20 0.34
KAT6A Q92794 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL4127202 0.82 CA1 (0.44) CA1CA2CA5ACA9PTPN1
SCHEMBL4126545 0.80 CA1 (0.42) CA1CA2CA5ACA9PTPN1
SCHEMBL29449807 0.78 TSHR (0.41) CA1CA2CA5ACA9PTPN1
SCHEMBL777648 0.75 ALDH1A1 (0.59) CA1CA2CA5ACA9PTPN1
SCHEMBL30669402 0.73 ALDH1A1 (0.42) CA1CA2CA5ACA9PTPN1
SCHEMBL4473696 0.73 ALDH1A1 (0.42) CA1CA2CA5ACA9TSHR
SCHEMBL27833496 0.73 CYP1A2 (0.42) CA1CA2CA5ACA9PTPN1
SCHEMBL16107475 0.72 MAPT (0.42) CA1CA2CA5ACA9TSHR
Acetonitrile SCHEMBL27533725 0.72 KMT2A (0.35) CA1CA2CA5ACA9PTPN1
SCHEMBL3870301 0.71 PTPN1 (0.67) CA1CA2CA5ACA9PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12100809-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2024-09-24 US disclosed
US-20220149436-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2022-05-12 US disclosed
US-11283107-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2022-03-22 US disclosed
EP-3621141-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2020-03-11 EP disclosed
US-20190229372-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2019-07-25 US disclosed
US-10333172-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2019-06-25 US disclosed
US-10290901-B2 2019-05-14 US disclosed
US-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-20170084955-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-23 US disclosed
US-20150188192-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-02 US disclosed
US-20150056503-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-02-26 US disclosed
EP-2012386-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY Mitsubishi Chemical Corporation (JP) 2009-01-07 EP disclosed