SCHEMBL4152528

SCHEMBL4152528

CCCCC(O)COP(=O)(O)O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR5 Q9H1C0 4/20 0.62
LPAR1 Q92633 11/20 0.57
LPAR3 Q9UBY5 8/20 0.57
LPAR2 Q9HBW0 5/20 0.57
LPAR4 Q99677 3/20 0.57
ENPP2 Q13822 3/20 0.57
LPAR6 P43657 2/20 0.57
SGPL1 O95470 4/20 0.50
CES2 O00748 1/20 0.49
TRPV1 Q8NER1 1/20 0.49
FDPS P14324 1/20 0.47

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
SCHEMBL28480885 0.94 LPAR5 (0.65) LPAR5LPAR1LPAR3LPAR2LPAR4
SCHEMBL10658463 0.92 LPAR5 (0.68) LPAR5LPAR1LPAR3LPAR2LPAR4
SCHEMBL10661421 0.92 LPAR5 (0.68) LPAR5LPAR1LPAR3LPAR2LPAR4
SCHEMBL9497069 0.92 LPAR5 (0.68) LPAR5LPAR1LPAR3LPAR2LPAR4
SCHEMBL28486997 0.92 LPAR5 (0.68) LPAR5LPAR1LPAR3LPAR2LPAR4
SCHEMBL25295001 0.88 LPAR5 (0.49) LPAR5LPAR1LPAR3LPAR2LPAR4
Dimethylamine SCHEMBL3403565 0.88 LPAR5 (0.62) LPAR5LPAR1LPAR3LPAR2LPAR4
SCHEMBL17107154 0.85 LPAR1 (0.48) LPAR5LPAR1LPAR3LPAR2LPAR4
SCHEMBL10656928 0.83 LPAR5 (0.60) LPAR5LPAR1LPAR3LPAR2LPAR4
SCHEMBL28541352 0.82 CYP3A4 (0.60) LPAR5LPAR1LPAR3LPAR2LPAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2001830-A1 GLYCERIDE ESTER DERIVATIVES OF HERBICIDAL COMPOUNDS AND COMPOSITIONS THEREOF NUFARM AUSTRALIA LIMITED (AU) 2008-12-17 EP claimed
WO-2007112505-A1 GLYCERIDE ESTER DERIVATIVES OF HERBICIDAL COMPOUNDS AND COMPOSITIONS THEREOF NUFARM AUSTRALIA LIMITED (AU) 2007-10-11 WO claimed
WO-2007030885-A1 AGROCHEMICAL EMULSIFIABLE CONCENTRATE NUFARM AUSTRALIA LIMITED (AU) 2007-03-22 WO claimed
US-20090247407-A1 Glyceride Ester Derivatives of Herbicidal Compounds and Compositions Thereof NUFARM AUSTRALIA LIMITED (AU) 2009-10-01 US disclosed
EP-2001830-A1 GLYCERIDE ESTER DERIVATIVES OF HERBICIDAL COMPOUNDS AND COMPOSITIONS THEREOF NUFARM AUSTRALIA LIMITED (AU) 2008-12-17 EP disclosed
US-20080254983-A1 Herbicide Composition NUFARM AUSTRALIA LIMITED (AU) 2008-10-16 US disclosed
EP-1933621-A1 HERBICIDE COMPOSITION NUFARM AUSTRALIA LIMITED (AU) 2008-06-25 EP disclosed
WO-2007112505-A1 GLYCERIDE ESTER DERIVATIVES OF HERBICIDAL COMPOUNDS AND COMPOSITIONS THEREOF NUFARM AUSTRALIA LIMITED (AU) 2007-10-11 WO disclosed
WO-2007030887-A1 HERBICIDE COMPOSITION NUFARM AUSTRALIA LIMITED (AU) 2007-03-22 WO disclosed
WO-2007030885-A1 AGROCHEMICAL EMULSIFIABLE CONCENTRATE NUFARM AUSTRALIA LIMITED (AU) 2007-03-22 WO disclosed
WO-2007030886-A1 HERBICIDE MIXTURES AND PROCESS FOR PREPARATION THEREOF NUFARM AUSTRALIA LIMITED (AU) 2007-03-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090247407-A1 Glyceride Ester Derivatives of Herbicidal Compounds and Compositions Thereof PYM1, GRM4, GPR4 LPAR5 1237/4885LPAR1 706/4885LPAR3 223/4885
US-20080254983-A1 Herbicide Composition DDT, HDHD5, CUL5 LPAR5 2906/4885LPAR1 4132/4885LPAR3 3233/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.