SCHEMBL27878799

SCHEMBL27878799

C#CCOC(=O)C(C)(OCC)P=O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
TSHR P16473 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
ZDHHC20 Q5W0Z9 1/20 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
SCHEMBL28568893 0.77 NPC1 (0.36) NPC1TSHRL3MBTL1ZDHHC20
SCHEMBL27862440 0.74 DGAT1 (0.34)
SCHEMBL28571907 0.74 NPC1 (0.34) NPC1TSHRL3MBTL1ZDHHC20
SCHEMBL27657800 0.72 NPC1 (0.41) NPC1TSHRL3MBTL1ZDHHC20
SCHEMBL2478567 0.72 NPC1 (0.41) NPC1TSHRL3MBTL1ZDHHC20
SCHEMBL12755486 0.71 NPC1 (0.37) NPC1TSHRL3MBTL1ZDHHC20
SCHEMBL27878786 0.70
SCHEMBL16815032 0.70 NPC1 (0.39) NPC1TSHRL3MBTL1ZDHHC20
SCHEMBL4677677 0.70 NPC1 (0.39) NPC1TSHRL3MBTL1ZDHHC20
SCHEMBL4677672 0.70 NPC1 (0.39) NPC1TSHRL3MBTL1ZDHHC20

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104795595-A Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES 2015-07-22 CN disclosed
CN-102498605-B Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES 2015-05-20 CN disclosed
CN-102498605-A Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES 2012-06-13 CN disclosed