SCHEMBL1921577

SCHEMBL1921577

CCC(OP(=O)(OC(CC)C(C)C)OC(CC)C(C)C)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
CTSA P10619 1/20 0.31
ACHE P22303 1/20 0.31
CYP3A4 P08684 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
TRPM8 Q7Z2W7 2/20 0.30

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
SCHEMBL28360605 0.80 TSHR (0.31) TSHR
SCHEMBL1923663 0.80 METAP1 (0.39) TSHRCYP3A4L3MBTL1TRPM8
SCHEMBL1921579 0.80 SMPD1 (0.41)
SCHEMBL4947114 0.75 SMPD1 (0.46) TRPM8
SCHEMBL24324345 0.74 MMP1 (0.33) TSHRACHECYP3A4L3MBTL1
SCHEMBL28915784 0.73 BTN3A1 (0.40)
SCHEMBL5964455 0.73 METAP1 (0.38) CYP3A4L3MBTL1TRPM8
SCHEMBL485994 0.72 TSHR (0.36) TSHRCTSAACHECYP3A4L3MBTL1
SCHEMBL19359788 0.69 TSHR (0.46) TSHRCYP3A4L3MBTL1
SCHEMBL907146 0.69 TSHR (0.38) TSHRCYP3A4L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2330675-B1 SECONDARY BATTERY NEC CORP (JP) 2018-08-22 EP disclosed
US-20120171542-A1 SECONDARY BATTERY NEC CORPORATION (JP) 2012-07-05 US disclosed
US-20110159379-A1 SECONDARY BATTERY NEC CORPORATION (JP) 2011-06-30 US disclosed
EP-2330675-A1 SECONDARY BATTERY NEC Corporation (JP) 2011-06-08 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