SCHEMBL8996001

SCHEMBL8996001

CCCCCC(C)(O)C#CO

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 11/20 0.39
GGPS1 O95749 7/20 0.39
CES2 O00748 1/20 0.36
SMPD1 P17405 1/20 0.34
LPAR1 Q92633 1/20 0.32
LPAR3 Q9UBY5 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
SCHEMBL28783022 0.98 FDPS (0.41) FDPSGGPS1CES2SMPD1LPAR1
SCHEMBL737213 0.88 FDPS (0.43) FDPSGGPS1CES2SMPD1LPAR1
SCHEMBL736677 0.86 FDPS (0.45) FDPSGGPS1CES2SMPD1
SCHEMBL15364769 0.86 FDPS (0.45) FDPSGGPS1CES2SMPD1
SCHEMBL737150 0.86 FDPS (0.45) FDPSGGPS1CES2SMPD1
SCHEMBL28379125 0.83
SCHEMBL10975924 0.82 FDPS (0.39) FDPSGGPS1CES2SMPD1
SCHEMBL10978855 0.82 FDPS (0.39) FDPSGGPS1CES2SMPD1
SCHEMBL10975926 0.82 FDPS (0.39) FDPSGGPS1CES2SMPD1
SCHEMBL396486 0.80 FDPS (0.34) FDPSGGPS1CES2

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
EP-0725165-A1 Brightening additive for tungsten alloy electroplate ENTHONE-OMI, Inc. (US) 1996-08-07 EP claimed
US-5525206-A Brightening additive for tungsten alloy electroplate ENTHONE-OMI, INC. (US) 1996-06-11 US claimed
EP-0725165-A1 Brightening additive for tungsten alloy electroplate ENTHONE-OMI, Inc. (US) 1996-08-07 EP disclosed
US-5525206-A Brightening additive for tungsten alloy electroplate ENTHONE-OMI, INC. (US) 1996-06-11 US disclosed