SCHEMBL780684

SCHEMBL780684

O=S(=O)(O)c1ccccc1C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.39
CA2 P00918 4/20 0.39
HSD11B1 P28845 8/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MYC P01106 1/20 0.35
SLC22A12 Q96S37 2/20 0.34
ALDH1A1 P00352 1/20 0.34
TTR P02766 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KAT6A Q92794 1/20 0.33
CA5A P35218 1/20 0.33
CA9 Q16790 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
SCHEMBL7652199 0.98 CA1 (0.41) CA1CA2HSD11B1MEN1KMT2A
SCHEMBL7652802 0.98 CA1 (0.41) CA1CA2HSD11B1MEN1KMT2A
SCHEMBL7653535 0.98 CA1 (0.41) CA1CA2HSD11B1MEN1KMT2A
SCHEMBL7159282 0.98 CA1 (0.41) CA1CA2HSD11B1MEN1KMT2A
SCHEMBL7649443 0.98 CA1 (0.41) CA1CA2HSD11B1MEN1KMT2A
SCHEMBL29155296 0.97 CA1 (0.40) CA1CA2HSD11B1MEN1KMT2A
SCHEMBL29069916 0.97 CA1 (0.40) CA1CA2HSD11B1MEN1KMT2A
Ammonia Solution, Strong SCHEMBL29155295 0.97 CA1 (0.40) CA1CA2HSD11B1MEN1KMT2A
SCHEMBL777675 0.95 HSD11B1 (0.39) CA1CA2HSD11B1MEN1KMT2A
SCHEMBL778821 0.87 HSD11B1 (0.41) CA1CA2HSD11B1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007017432-A1 PROCESS FOR PRODUCING ARYLBORONIC ACID ESTERS BASF AKTIENGESELLSCHAFT (DE) 2007-02-15 WO claimed
US-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-9343777-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-05-17 US disclosed
US-9252457-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-02-02 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-20120177988-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-07-12 US disclosed
US-20120070731-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-03-22 US disclosed
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed
WO-2007017432-A1 PROCESS FOR PRODUCING ARYLBORONIC ACID ESTERS BASF AKTIENGESELLSCHAFT (DE) 2007-02-15 WO disclosed