SCHEMBL27430832

SCHEMBL27430832

CCCCCCCCCCCCCCCCOC(=O)P(=O)(O)O

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 3/20 0.55
LPAR1 Q92633 2/20 0.55
LPAR2 Q9HBW0 2/20 0.55
NAAA Q02083 1/20 0.55
EPHX1 P07099 1/20 0.52
TSHR P16473 3/20 0.50
HCAR2 Q8TDS4 1/20 0.47
RAD52 P43351 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
FAAH O00519 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
ACHE P22303 4/20 0.46

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
SCHEMBL6733974 1.00 LPAR3 (0.55) LPAR3LPAR1LPAR2NAAAEPHX1
SCHEMBL6739566 1.00 LPAR3 (0.55) LPAR3LPAR1LPAR2NAAAEPHX1
SCHEMBL6734330 1.00 LPAR3 (0.55) LPAR3LPAR1LPAR2NAAAEPHX1
SCHEMBL4479861 0.93 LPAR3 (0.48) LPAR3LPAR1LPAR2NAAAEPHX1
SCHEMBL8465669 0.91 ALDH1A1 (0.54) LPAR3LPAR1LPAR2NAAAEPHX1
Butane SCHEMBL2239751 0.89 ALDH1A1 (0.52) LPAR3LPAR1LPAR2NAAAEPHX1
SCHEMBL6893233 0.89 MEN1 (0.50) LPAR3LPAR1LPAR2NAAAEPHX1
SCHEMBL6741785 0.80 NAAA (0.52) LPAR3LPAR1LPAR2NAAAEPHX1
SCHEMBL6740544 0.80 NAAA (0.52) LPAR3LPAR1LPAR2NAAAEPHX1
SCHEMBL6734697 0.80 NAAA (0.52) LPAR3LPAR1LPAR2NAAAEPHX1

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-1085672-C Phospholipid derivatives of phosphono-carboxylic acids, prodn. and use as antiviral ROCHE DIAGNOSTICS GMBH (DE) 2002-05-29 CN disclosed
CN-1209133-A Novel phospholipid derivatives of phosphonocarboxylic acids, method for the production thereof and use thereof as antiviral agents BOEHRINGER MANNHEIM GMBH (DE) 1999-02-24 CN disclosed
CN-1209069-A Covalent lipit-phosphono-carboxylic acid conjugates and application thereof as antiviral medicaments BOEHRINGER MANNHEIM GMBH (DE) 1999-02-24 CN disclosed