SCHEMBL9937890

SCHEMBL9937890

CCOCC(=O)OCC(C)OCC

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.35
TDP1 Q9NUW8 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 1/20 0.33
ALDH1A1 P00352 3/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
TRPA1 O75762 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
SCHEMBL9936569 0.85 TSHR (0.35) TSHRTDP1L3MBTL1MAPTALDH1A1
SCHEMBL9936908 0.85 TSHR (0.35) TSHRTDP1L3MBTL1MAPTALDH1A1
SCHEMBL9936665 0.83 HTT (0.34) TSHRTDP1L3MBTL1
SCHEMBL9936602 0.83 HTT (0.34) TSHRTDP1L3MBTL1
SCHEMBL445901 0.82 NAAA (0.38) TSHRTDP1L3MBTL1MAPTALDH1A1
SCHEMBL2700961 0.78 NAAA (0.35) TSHRTDP1MAPTALDH1A1MGAM
SCHEMBL27646329 0.78 MAPT (0.46) TSHRTDP1MAPTALDH1A1LMNA
SCHEMBL9936248 0.78 MAPT (0.34) TSHRTDP1MAPTALDH1A1MGAM
SCHEMBL2586982 0.78 TSHR (0.38) TSHRTDP1MAPTALDH1A1MGAM
SCHEMBL1469447 0.77 ALDH1A1 (0.48) TSHRTDP1MAPTALDH1A1MGAM

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-9472813-B2 Battery electrolyte solution containing certain ester-based solvents, and batteries containing such an electrolyte solution DOW GLOBAL TECHNOLOGIES LLC (US) 2016-10-18 US disclosed
EP-2652832-A1 BATTERY ELECTROLYTE SOLUTION CONTAINING CERTAIN ESTER-BASED SOLVENTS, AND BATTERIES CONTAINING SUCH AN ELECTROLYTE SOLUTION Dow Global Technologies LLC (US) 2013-10-23 EP disclosed
US-20130260229-A1 BATTERY ELECTROLYTE SOLUTION CONTAINING CERTAIN ESTER-BASED SOLVENTS, AND BATTERIES CONTAINING SUCH AN ELECTROLYTE SOLUTION DOW GLOBAL TECHNOLOGIES LLC (US) 2013-10-03 US disclosed
WO-2012082760-A1 BATTERY ELECTROLYTE SOLUTION CONTAINING CERTAIN ESTER-BASED SOLVENTS, AND BATTERIES CONTAINING SUCH AN ELECTROLYTE SOLUTION DOW GLOBAL TECHNOLOGIES LLC (US) 2012-06-21 WO disclosed