SCHEMBL15323710

SCHEMBL15323710

O=COCC(COC(=O)CCC(=O)O)OC(=O)CCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
ALDH1A1 P00352 1/20 0.46
PRKCA P17252 2/20 0.40
PRKCE Q02156 2/20 0.40
PRKCQ Q04759 2/20 0.40
PRKCD Q05655 2/20 0.40
LPAR3 Q9UBY5 7/20 0.38
LPAR1 Q92633 4/20 0.38
ENPP2 Q13822 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LPAR2 Q9HBW0 2/20 0.38
TLR2 O60603 2/20 0.34

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
SCHEMBL15323877 0.92 ALDH1A1 (0.40) LMNAALDH1A1PRKCAPRKCEPRKCQ
SCHEMBL1405394 0.88 LMNA (0.56) LMNAALDH1A1PRKCAPRKCEPRKCQ
SCHEMBL15323825 0.81 ALDH1A1 (0.37) LMNAALDH1A1PRKCAPRKCEPRKCQ
SCHEMBL13814117 0.80 ALDH1A1 (0.54) LMNAALDH1A1PRKCAPRKCEPRKCQ
SCHEMBL19506623 0.79 ALDH1A1 (0.53) LMNAALDH1A1PRKCAPRKCEPRKCQ
SCHEMBL29931094 0.79 ALDH1A1 (0.62) LMNAALDH1A1PRKCAPRKCEPRKCQ
SCHEMBL5026886 0.79 PRKCA (0.60) LMNAALDH1A1PRKCAPRKCEPRKCQ
SCHEMBL15323712 0.79 LMNA (0.37) LMNAALDH1A1PRKCAPRKCEPRKCQ
SCHEMBL19300632 0.79 ALDH1A1 (0.36) LMNAALDH1A1PRKCAPRKCEPRKCQ
SCHEMBL24634800 0.78 ALDH1A1 (0.79) LMNAALDH1A1PRKCAPRKCEPRKCQ

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
EP-2836833-A1 PRENATAL SCREENING FOR DOWN SYNDROME AND TRISOMY 18 Wayne State University (US) 2015-02-18 EP disclosed
WO-2013155456-A1 PRENATAL SCREENING FOR DOWN SYNDROME AND TRISOMY 18 WAYNE STATE UNIVERSITY (US) 2013-10-17 WO disclosed