SCHEMBL5963462

SCHEMBL5963462

CCCC(CCC)(CC(F)(F)F)OP(=O)(O)O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.42
FDPS P14324 5/20 0.38
LPAR3 Q9UBY5 4/20 0.36
LPAR1 Q92633 3/20 0.36
LPAR2 Q9HBW0 2/20 0.31
GGPS1 O95749 2/20 0.31
S1PR2 O95136 1/20 0.31
S1PR4 O95977 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31

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
SCHEMBL5963626 0.93 SMPD1 (0.40) SMPD1FDPSLPAR3LPAR1LPAR2
SCHEMBL5963256 0.84 SMPD1 (0.36) SMPD1FDPSLPAR3LPAR1LPAR2
SCHEMBL5908958 0.83 SMPD1 (0.50) SMPD1FDPSLPAR3LPAR1LPAR2
SCHEMBL20162319 0.83 FDPS (0.36) SMPD1FDPS
SCHEMBL5964082 0.81 SMPD1 (0.40) SMPD1FDPSLPAR3LPAR1
SCHEMBL28489212 0.80 SMPD1 (0.32) SMPD1FDPS
SCHEMBL5908847 0.79 SMPD1 (0.47) SMPD1FDPSLPAR3LPAR1LPAR2
SCHEMBL5908917 0.79 SMPD1 (0.47) SMPD1FDPSLPAR3LPAR1LPAR2
SCHEMBL5963285 0.79 SMPD1 (0.41) SMPD1FDPSLPAR3LPAR1S1PR2
SCHEMBL11237294 0.78 SMPD1 (0.46) SMPD1FDPSLPAR3LPAR1LPAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108701812-B Negative electrode for lithium secondary battery and lithium secondary battery 日本电气株式会社 2022-09-23 CN disclosed
CN-111066188-A Lithium ion secondary battery 日本电气株式会社 2020-04-24 CN disclosed
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