SCHEMBL5963843

SCHEMBL5963843

CCCCC(F)(OP(=O)(O)O)C(F)(F)C(F)(F)C(C)(F)F

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.45
LPAR3 Q9UBY5 4/20 0.40
LPAR1 Q92633 3/20 0.40
FDPS P14324 11/20 0.38
GGPS1 O95749 7/20 0.34
LPAR2 Q9HBW0 2/20 0.34
S1PR2 O95136 1/20 0.33
S1PR4 O95977 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33

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
SCHEMBL5963707 0.87 SMPD1 (0.45) SMPD1LPAR3LPAR1FDPSGGPS1
SCHEMBL5963412 0.84 SMPD1 (0.41) SMPD1LPAR3LPAR1FDPSS1PR2
SCHEMBL5963832 0.74 SMPD1 (0.41) SMPD1LPAR3LPAR1FDPSS1PR2
SCHEMBL7103306 0.73 SMPD1 (0.32) SMPD1
SCHEMBL5963470 0.72 SMPD1 (0.40) SMPD1LPAR3LPAR1FDPSLPAR2
SCHEMBL215087 0.72 SMPD1 (0.55) SMPD1LPAR3LPAR1FDPSGGPS1
SCHEMBL29245249 0.72 SMPD1 (0.55) SMPD1LPAR3LPAR1FDPSGGPS1
SCHEMBL5964237 0.72 SMPD1 (0.37) SMPD1LPAR3LPAR1LPAR2
SCHEMBL28653187 0.70 SMPD1 (0.57) SMPD1LPAR3LPAR1FDPSGGPS1
SCHEMBL30807986 0.70 PGK1 (0.32) SMPD1

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-20190123337-A1 NEGATIVE ELECTRODE FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY NEC CORPORATION (JP) 2019-04-25 US disclosed
US-9935337-B2 Lithium secondary battery NEC CORPORATION (JP) 2018-04-03 US disclosed
EP-2876723-B1 LITHIUM SECONDARY BATTERY NEC CORP (JP) 2017-02-01 EP disclosed
US-20150171477-A1 LITHIUM SECONDARY BATTERY NEC CORPORATION (JP) 2015-06-18 US disclosed
EP-2876723-A1 LITHIUM SECONDARY BATTERY Nec Corporation (JP) 2015-05-27 EP disclosed
US-20060172201-A1 Non-aqueous electrolyte and lithium secondary battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2006-08-03 US disclosed
EP-1357628-A1 NONAQUEOUS ELECTROLYTIC LIQUIDS AND LITHIUM SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2003-10-29 EP disclosed