SCHEMBL4124339

SCHEMBL4124339

CCP(=O)(Oc1ccc(-c2ccccc2)cc1F)Oc1ccc(-c2ccccc2)cc1F

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.40
ABCB1 P08183 2/20 0.40
ABCC1 P33527 1/20 0.39
FFAR1 O14842 6/20 0.38
PPARD Q03181 2/20 0.38
SLC6A9 P48067 1/20 0.38
MCHR1 Q99705 1/20 0.37
ACLY P53396 2/20 0.36
ERN1 O75460 1/20 0.36
XBP1 P17861 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MGLL Q99685 1/20 0.36
HTR2A P28223 1/20 0.35
SLC6A4 P31645 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35

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
SCHEMBL4131673 0.86 RARB (0.39) CYP17A1ABCB1MGLL
SCHEMBL4137899 0.83 ABCB1 (0.42) CYP17A1ABCB1ABCC1FFAR1PPARD
SCHEMBL18632008 0.79 HTT (0.53) XBP1HTTNPSR1
SCHEMBL8481713 0.73 CYP17A1 (0.57) CYP17A1ABCB1ABCC1FFAR1ACLY
SCHEMBL4124202 0.73 TUBB1 (0.36) XBP1HTTNPSR1
SCHEMBL4138941 0.71 PTGDR (0.38) ABCB1ABCC1FFAR1PPARDSLC6A9
SCHEMBL4132308 0.71 ALDH1A1 (0.46) PPARDHTTPTGS1
SCHEMBL27702813 0.70 CFD (0.56) ABCB1ABCC1SLC6A9PTGS1PTGS2
SCHEMBL7786753 0.70 PTPN11 (0.53)
SCHEMBL7788886 0.70 PTPN11 (0.53)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12100809-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2024-09-24 US disclosed
US-20220149436-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2022-05-12 US disclosed
US-11283107-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2022-03-22 US disclosed
EP-3621141-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2020-03-11 EP disclosed
US-20190229372-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2019-07-25 US disclosed
US-10333172-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2019-06-25 US disclosed
US-10290901-B2 2019-05-14 US disclosed
US-20170084955-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-23 US disclosed
US-20150056503-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-02-26 US disclosed
EP-2012386-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY Mitsubishi Chemical Corporation (JP) 2009-01-07 EP disclosed