SCHEMBL14178403

SCHEMBL14178403

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

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
DUSP3 P51452 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
LMNA P02545 1/20 0.50
DGKA P23743 1/20 0.43
TSHR P16473 3/20 0.43
FAAH O00519 4/20 0.42
THRB P10828 1/20 0.41
CNR2 P34972 4/20 0.38
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PRKCA P17252 1/20 0.33

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
SCHEMBL275282 0.94 KDM4E (0.50) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL29261094 0.85 TSHR (0.55) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL25707 0.83 TSHR (0.61) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL29375450 0.83 TSHR (0.61) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL16863053 0.83 TSHR (0.61) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL2830658 0.83 KDM4E (0.51) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL5484572 0.82 TSHR (0.52) KDM4EDUSP3MEN1KMT2ALMNA
Methane SCHEMBL28897391 0.81 TSHR (0.59) KDM4EDUSP3MEN1KMT2ALMNA
Glycerin SCHEMBL28100194 0.81 TSHR (0.59) KDM4EDUSP3MEN1KMT2ALMNA
Ethylene SCHEMBL27572484 0.81 TSHR (0.59) KDM4EDUSP3MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7374863-B2 Polyurethane binder, photoinitiator, and acrylic acid; for use as image recording layer of negative lithographic printing plate precursor; drawing with laser light FUJIFILM CORPORATION (JP) 2008-05-20 US disclosed