SCHEMBL780161

SCHEMBL780161

O=S(=O)(O)c1ccc(Cc2ccccc2F)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.47
CA2 P00918 4/20 0.47
LMNA P02545 4/20 0.47
TSHR P16473 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PTPN1 P18031 1/20 0.43
CA9 Q16790 1/20 0.42
TAS2R14 Q9NYV8 2/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
GAA P10253 1/20 0.41
RECQL P46063 1/20 0.41
ALDH1A1 P00352 3/20 0.41
POLB P06746 1/20 0.41
CYP2D6 P10635 1/20 0.41
CXCR3 P49682 1/20 0.39
NT5E P21589 1/20 0.38
KEAP1 Q14145 1/20 0.38

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
SCHEMBL776845 0.87 CA1 (0.39) CA1CA2LMNATSHRSMN1; SMN2
SCHEMBL28353192 0.81 TSHR (0.47) CA1CA2LMNATSHRSMN1; SMN2
SCHEMBL780395 0.80 HTR2A (0.51) CA1CA2SMN1; SMN2CA9TAS2R14
SCHEMBL5597376 0.79 CA2 (0.55) CA1CA2LMNATSHRSMN1; SMN2
SCHEMBL3151100 0.77 TSHR (0.62) CA1CA2LMNATSHRSMN1; SMN2
SCHEMBL9619529 0.77 LMNA (0.56) CA1CA2LMNATSHRSMN1; SMN2
SCHEMBL27902405 0.76 KEAP1 (0.64) KMT2AMEN1GAAALDH1A1KEAP1
SCHEMBL778955 0.76 EGFR (0.47) CA1CA2LMNATSHRSMN1; SMN2
SCHEMBL11208943 0.76 TAS2R14 (0.45) LMNATSHRSMN1; SMN2TAS2R14GAA
SCHEMBL11231658 0.76 KMT2A (0.59) CA1CA2LMNASMN1; SMN2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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