SCHEMBL776612

SCHEMBL776612

O=S(O)(O)(c1ccccc1)C(F)F

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.31
SRC P12931 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GLA P06280 1/20 0.30
TSHR P16473 1/20 0.30
LMNA P02545 2/20 0.30
MAPK1 P28482 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
SCHEMBL778791 0.82 KMT2A (0.32) CYP2D6ALDH1A1GLATSHRLMNA
SCHEMBL778850 0.76 CES1 (0.34) ALDH1A1TSHRMAPK1
SCHEMBL776012 0.73 PGR (0.33) TSHRLMNA
SCHEMBL5042529 0.72 CES1 (0.33) ALDH1A1GLATSHR
SCHEMBL15046696 0.71
SCHEMBL6003247 0.71 BBOX1 (0.33) ALDH1A1TSHR
SCHEMBL10639940 0.71 NPSR1 (0.38) CYP2D6ALDH1A1GLATSHRMAPK1
SCHEMBL278265 0.71 TSHR (0.39) ALDH1A1GLATSHR
Benzene SCHEMBL28958130 0.71 TSHR (0.39) ALDH1A1GLATSHR
SCHEMBL6009579 0.67 CA2 (0.35) ALDH1A1GLATSHRLMNA

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