SCHEMBL9958025

SCHEMBL9958025

O=S(=O)(CC(F)(F)F)Oc1cccc2c1CCCC2

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRA P19793 8/20 0.41
RXRB P28702 8/20 0.41
RXRG P48443 5/20 0.41
DRD2 P14416 3/20 0.40
HTR1D P28221 2/20 0.40
DRD3 P35462 2/20 0.40
LMNA P02545 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.37
HTR1A P08908 1/20 0.37
HTR7 P34969 1/20 0.37
HTR6 P50406 1/20 0.37
BCL2L1 Q07817 1/20 0.37
BAD Q92934 1/20 0.37

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
SCHEMBL9958122 0.82 RXRA (0.45) RXRARXRBRXRGDRD2HTR1D
SCHEMBL1820878 0.81 DRD2 (0.53) RXRARXRBRXRGDRD2HTR1D
SCHEMBL3113928 0.78 DRD2 (0.53) RXRARXRBRXRGDRD2HTR1D
SCHEMBL9958134 0.75 RXRA (0.43) RXRARXRBRXRGLMNAMRGPRX4
SCHEMBL926367 0.75 CNR2 (0.33)
SCHEMBL15335809 0.74 RXRA (0.49) RXRARXRBRXRGDRD2LMNA
SCHEMBL9957392 0.72 STS (0.57) RXRARXRBRXRGDRD2HTR1D
SCHEMBL30042062 0.71 DRD2 (0.55) DRD2HTR1DDRD3
SCHEMBL10494213 0.70 PNMT (0.33) LMNANPSR1MRGPRX4
SCHEMBL27267547 0.70 HTT (0.47) HTR1D

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-9029024-B2 Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES, LTD. (JP) 2015-05-12 US disclosed
EP-2469638-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND ELECTROCHEMICAL DEVICE USING THE SAME UBE INDUSTRIES (JP) 2014-10-01 EP disclosed
US-20120189919-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2012-07-26 US disclosed
EP-2469638-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2012-06-27 EP disclosed