SCHEMBL780122

SCHEMBL780122

O=P(O)(c1ccc(F)cc1)c1ccc(F)cc1-c1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
PTGS2 P35354 3/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
PTPN5 P54829 1/20 0.33
PTGS1 P23219 1/20 0.33
MAP4K4 O95819 1/20 0.33
CA12 O43570 1/20 0.33
MMP2 P08253 1/20 0.33
BCL2L1 Q07817 1/20 0.32
BAD Q92934 1/20 0.32
TOP1 P11387 1/20 0.32
NTRK1 P04629 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 2/20 0.32
HPGD P15428 2/20 0.32

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
SCHEMBL28394456 0.78 TOP1 (0.41) PTGS2CA2PTPN5PTGS1CA12
SCHEMBL7775596 0.74 LMNA (0.56) LMNATSHRCA1CA2CA12
SCHEMBL11991140 0.66 BCL2L1 (0.46) LMNATSHRCA1CA2CA7
SCHEMBL1567573 0.66 CA2 (0.55) LMNATSHRCA1CA2CA12
SCHEMBL3750242 0.65 PTGS2 (0.41) PTGS2CA1CA2CA7CA9
SCHEMBL9743853 0.65 IDO1 (0.55) LMNAPTGS2CA1CA2CA9
SCHEMBL28383735 0.65 PTPN5 (0.46) TSHRCA1PTPN5CA12MMP2
SCHEMBL24766983 0.64 CA3 (0.44) PTGS2CA9PTGS1ALDH1A1PTPN1
SCHEMBL29250098 0.63 DRD1 (0.43) LMNATSHRCA2PTPN5PTGS1
SCHEMBL3646058 0.63 CA2 (0.46) TSHRCA2BCL2L1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-9343777-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-05-17 US disclosed
US-9252457-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-02-02 US disclosed
US-20150188192-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-02 US disclosed
US-20120177988-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-07-12 US disclosed
US-20120070731-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-03-22 US disclosed
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed