SCHEMBL9936648

SCHEMBL9936648

CCOCC(=O)OC(C)COCC(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLA2G2C Q5R387 1/20 0.37
HTT P42858 1/20 0.32
CYP2C9 P11712 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 1/20 0.30
HIF1A Q16665 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL9936774 0.94 PLA2G2C (0.34) PLA2G2CHTT
SCHEMBL9937083 0.92 PLA2G2C (0.36) PLA2G2CHTT
SCHEMBL9936273 0.85 PLA2G2C (0.35) PLA2G2CHTTCYP2C9TSHRCYP2C19
SCHEMBL9936419 0.85 PLA2G2C (0.39) PLA2G2CHTTCYP2C9TSHRCYP2C19
SCHEMBL9937292 0.84 FAAH (0.31) TSHR
SCHEMBL15284295 0.82 PLA2G2C (0.35) PLA2G2CHTT
SCHEMBL9937483 0.78 FAAH (0.31)
SCHEMBL9937228 0.78 GAA (0.33) TSHR
SCHEMBL28051942 0.78 TSHR (0.42) PLA2G2CHTTCYP2C9TSHRCYP2C19
SCHEMBL9936602 0.76 HTT (0.34) PLA2G2CHTTTSHR

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-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
CN-103262329-B Battery electrolyte solution containing certain ester-based solvents and battery containing such electrolyte solution DOW GLOBAL TECHNOLOGIES LLC (US) 2016-02-10 CN 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