SCHEMBL2992945

SCHEMBL2992945

O=C(CP(=O)(O)O)C(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
BLM P54132 1/20 0.37
KMT2A Q03164 1/20 0.37
ENO1 P06733 1/20 0.33
KDM4E B2RXH2 1/20 0.32
PGK1 P00558 1/20 0.32
PGK2 P07205 1/20 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
SCHEMBL2988768 0.82 TSHR (0.40) TSHRTDP1MEN1LMNAHPGD
SCHEMBL13274641 0.79 PGK1 (0.35) TSHRTDP1KDM4EPGK1PGK2
SCHEMBL2994669 0.70 MEN1 (0.37) TSHRTDP1MEN1LMNAHPGD
SCHEMBL1630007 0.64 KDM4E (0.43) TSHRTDP1KDM4EPGK1PGK2
SCHEMBL147193 0.64 TDP1 (0.46) TSHRTDP1MEN1LMNAHPGD
SCHEMBL776761 0.62 KDM4E (0.33) TSHRTDP1KDM4E
SCHEMBL14617621 0.62 TDP1 (0.43) TSHRTDP1MEN1LMNAHPGD
SCHEMBL28728326 0.62 MEN1 (0.43) TSHRTDP1MEN1LMNAHPGD
SCHEMBL2984746 0.61
SCHEMBL2995889 0.61 PGK1 (0.37) PGK1PGK2

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-8962192-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2015-02-24 US disclosed
US-8574757-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2013-11-05 US disclosed
US-20120264011-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-10-18 US disclosed
US-20100035147-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2010-02-11 US disclosed