SCHEMBL7183712

SCHEMBL7183712

CCCCCCCCCCCCCCCCCCC(C)(O)P(=O)=O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 10/20 0.52
GGPS1 O95749 7/20 0.52
SMPD1 P17405 2/20 0.42
CES2 O00748 1/20 0.41
LPAR1 Q92633 1/20 0.41
LPAR3 Q9UBY5 1/20 0.41

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
SCHEMBL8910838 0.79 FDPS (0.43) FDPSGGPS1SMPD1CES2
SCHEMBL16360116 0.79 FDPS (0.43) FDPSGGPS1SMPD1CES2
SCHEMBL2780873 0.79 FDPS (0.54) FDPSGGPS1SMPD1CES2LPAR1
SCHEMBL11572196 0.72 FDPS (0.50) FDPSGGPS1SMPD1CES2
SCHEMBL2188894 0.72 FDPS (0.50) FDPSGGPS1SMPD1
SCHEMBL24761603 0.72 FDPS (0.50) FDPSGGPS1SMPD1CES2
SCHEMBL2051180 0.72 FDPS (0.50) FDPSGGPS1SMPD1
SCHEMBL2346921 0.72 FDPS (0.50) FDPSGGPS1SMPD1CES2
SCHEMBL308388 0.72 FDPS (0.50) FDPSGGPS1SMPD1
SCHEMBL9374930 0.72 FDPS (0.50) FDPSGGPS1SMPD1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6506393-B2 Administering phosphocholine compound; leishmaniasis treatment ZENTARIS AG (DE) 2003-01-14 US disclosed
US-6254879-B1 QUATERNARIUMAMINOETHYLPHOSPHATES Max-Planck-Gessellschaft zun Förderung der Wissenschaften e.V. (DE) 2001-07-03 US disclosed