SCHEMBL9937287

SCHEMBL9937287

COCC(=O)OCCOCC(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.35
THRB P10828 1/20 0.34
CA2 P00918 1/20 0.32
ALDH1A1 P00352 2/20 0.31
TSHR P16473 1/20 0.31
PLA2G2C Q5R387 1/20 0.31
EPHX2 P34913 1/20 0.30
CES2 O00748 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
SCHEMBL9937397 0.85 HTT (0.35) HTTALDH1A1TSHRPLA2G2CCES2
SCHEMBL9936943 0.84 ALDH1A1 (0.42) HTTTHRBALDH1A1TSHRPLA2G2C
SCHEMBL9937439 0.82 HTT (0.46) HTTALDH1A1TSHR
SCHEMBL2610085 0.82 TSHR (0.39) THRBCA2ALDH1A1TSHR
SCHEMBL18470077 0.82 TSHR (0.39) THRBCA2ALDH1A1TSHR
SCHEMBL9936931 0.81 NAAA (0.44) HTTTHRBALDH1A1TSHRPLA2G2C
SCHEMBL9937457 0.80 ALDH1A1 (0.47) HTTTHRBALDH1A1TSHRPLA2G2C
SCHEMBL9936958 0.79 HTT (0.39) HTTTHRBALDH1A1TSHRPLA2G2C
SCHEMBL13153236 0.79 CA2 (0.37) HTTCA2
SCHEMBL13313904 0.78 TSHR (0.39) THRBCA2ALDH1A1TSHR

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 6 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
CN-103262329-A Battery electrolyte solution containing certain ester-based solvents and battery containing such electrolyte solution DOW GLOBAL TECHNOLOGIES INC 2013-08-21 CN 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