SCHEMBL14780382

SCHEMBL14780382

CCCCCC(OS(=O)(=O)c1ccccc1)C(C)OS(=O)(=O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 2/20 0.39
NR1I2 O75469 1/20 0.38
TSHR P16473 1/20 0.38
MMP1 P03956 3/20 0.38
MMP7 P09237 3/20 0.38
MMP12 P39900 3/20 0.38
MMP13 P45452 3/20 0.38
ACE P12821 2/20 0.38
PSIP1 O75475 1/20 0.38
ABCB1 P08183 2/20 0.36
CTRC Q99895 1/20 0.36
CNR2 P34972 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL14779119 0.98 SMN1; SMN2 (0.41) SMN1; SMN2TDP1ALDH1A1NR1I2TSHR
SCHEMBL14778341 0.95 SMN1; SMN2 (0.43) SMN1; SMN2TDP1ALDH1A1TSHRMMP1
SCHEMBL14778474 0.89 SMN1; SMN2 (0.49) SMN1; SMN2TDP1ALDH1A1TSHRMMP1
SCHEMBL14778708 0.87 CA12 (0.43) SMN1; SMN2TDP1ALDH1A1NR1I2TSHR
SCHEMBL14779807 0.85 MCHR1 (0.43) SMN1; SMN2TDP1ALDH1A1NR1I2TSHR
SCHEMBL14779840 0.84 ALDH1A1 (0.47) SMN1; SMN2TDP1ALDH1A1TSHRMMP1
SCHEMBL14779692 0.84 PSIP1 (0.45) SMN1; SMN2TDP1ALDH1A1PSIP1ABCB1
SCHEMBL14778762 0.83 ALDH1A1 (0.49) SMN1; SMN2TDP1ALDH1A1NR1I2TSHR
SCHEMBL8169996 0.83 ALDH1A1 (0.49) SMN1; SMN2TDP1ALDH1A1NR1I2TSHR
SCHEMBL9151537 0.83 ALDH1A1 (0.49) SMN1; SMN2TDP1ALDH1A1NR1I2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9240614-B2 Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES, LTD. (JP) 2016-01-19 US disclosed
EP-2579377-B1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES (JP) 2014-09-03 EP disclosed
EP-2579377-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2013-04-10 EP disclosed
US-20130071733-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2013-03-21 US disclosed