SCHEMBL10179546

SCHEMBL10179546

CCC(=O)Oc1cccc(C(F)(F)F)c1C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.40
KCNK3 O14649 1/20 0.40
KCNK9 Q9NPC2 1/20 0.40
ATM Q13315 1/20 0.39
MRGPRX4 Q96LA9 2/20 0.38
ACHE P22303 2/20 0.38
ALOX15 P16050 1/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
ESR1 P03372 1/20 0.37
HIF1A Q16665 1/20 0.37
CTSS P25774 4/20 0.37
LMNA P02545 1/20 0.37
ELANE P08246 1/20 0.36
CTSK P43235 1/20 0.36

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
SCHEMBL15765734 0.87 PPARG (0.42) PPARGKCNK3KCNK9ATMMRGPRX4
SCHEMBL2002076 0.85 PPARG (0.50) PPARGKCNK3KCNK9ATMMRGPRX4
SCHEMBL7711563 0.83 PPARG (0.43) PPARGKCNK3KCNK9ATMMRGPRX4
SCHEMBL15453647 0.83 HPGD (0.46) PPARGKCNK3KCNK9ATMMRGPRX4
SCHEMBL15763934 0.82 MEN1 (0.43) PPARGKCNK3KCNK9ATMMRGPRX4
SCHEMBL7178755 0.82 MAPK1 (0.44) PPARGKCNK3KCNK9MRGPRX4ACHE
SCHEMBL11217182 0.82 MRGPRX4 (0.39) PPARGKCNK3KCNK9ATMMRGPRX4
SCHEMBL15454263 0.82 MRGPRX4 (0.39) PPARGKCNK3KCNK9ATMMRGPRX4
SCHEMBL10934851 0.80 MRGPRX4 (0.41) PPARGKCNK3KCNK9ATMMRGPRX4
SCHEMBL10180060 0.80 CTSS (0.43) KCNK3KCNK9ACHEKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130244122-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME ONUKI MASAMICHI (JP) 2013-09-19 US disclosed
US-20120219866-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-30 US disclosed
EP-2475041-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION, AND NON-AQUEOUS ELECTROLYTE BATTERY COMPRISING SAME Mitsubishi Chemical Corporation (JP) 2012-07-11 EP disclosed