SCHEMBL778029

SCHEMBL778029

O=S(=O)(O)c1ccc(CC=CF)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
TSHR P16473 3/20 0.42
ALDH1A1 P00352 2/20 0.42
NT5E P21589 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.40
CYP2D6 P10635 2/20 0.36
POLB P06746 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 1/20 0.35
CA12 O43570 5/20 0.34
CA1 P00915 5/20 0.34
CA2 P00918 5/20 0.34
CA9 Q16790 5/20 0.34
CA4 P22748 4/20 0.34
CA6 P23280 4/20 0.34
CA5A P35218 4/20 0.34
CA7 P43166 4/20 0.34
CA14 Q9ULX7 4/20 0.34
CA5B Q9Y2D0 4/20 0.34

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
SCHEMBL10453223 0.81 ENPP2 (0.42)
SCHEMBL10453222 0.81 ENPP2 (0.42)
SCHEMBL10453221 0.81 ENPP2 (0.42)
SCHEMBL18637980 0.81 TSHR (0.47) LMNATDP1TSHRALDH1A1NT5E
SCHEMBL8386014 0.79 LMNA (0.50) LMNATDP1TSHRALDH1A1NT5E
SCHEMBL8089442 0.77 LMNA (0.39) LMNATDP1TSHRALDH1A1NT5E
SCHEMBL87584 0.76 TDP1 (0.55) LMNATDP1TSHRALDH1A1NT5E
SCHEMBL4132583 0.74 TDP1 (0.53) LMNATDP1TSHRALDH1A1NT5E
Ammonia Solution, Strong SCHEMBL6669195 0.74 TDP1 (0.53) LMNATDP1TSHRALDH1A1NT5E
SCHEMBL22273552 0.74 LMNA (0.37) LMNATDP1TSHRALDH1A1NT5E

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