SCHEMBL4671980

SCHEMBL4671980

O=C(O)OCC(CO)OCC(O)CO

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
KDM4E B2RXH2 1/20 0.36
DUSP3 P51452 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PRKCA P17252 4/20 0.35
OR51E2 Q9H255 1/20 0.34
DGKA P23743 1/20 0.31
PRKCE Q02156 1/20 0.31
PRKCQ Q04759 1/20 0.31
PRKCD Q05655 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL2905861 0.83
SCHEMBL44489 0.83
SCHEMBL2904699 0.83
SCHEMBL8107235 0.82 CYP1A2 (0.38) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL4737040 0.82 PRKCA (0.39) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL5030996 0.81 LMNA (0.46) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL6009745 0.81 LMNA (0.46) LMNAKDM4EDUSP3MEN1KMT2A
Ammonia Solution, Strong SCHEMBL29173217 0.81 LMNA (0.46) LMNAKDM4EDUSP3MEN1KMT2A
Bicarbonate SCHEMBL3335344 0.81 LMNA (0.46) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL8033641 0.79 LMNA (0.44) LMNAKDM4EDUSP3MEN1KMT2A

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-1981598-A2 PLASTICIZER OF NATURAL ORIGIN FOR NAIL POLISH Durlin France (FR) 2008-10-22 EP disclosed
WO-2007080172-A2 PLASTICIZER OF NATURAL ORIGIN FOR NAIL POLISH DURLIN FRANCE (FR) 2007-07-19 WO disclosed