SCHEMBL3716635

SCHEMBL3716635

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

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.43
KDM4E B2RXH2 1/20 0.43
DUSP3 P51452 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 1/20 0.43
FAAH O00519 4/20 0.42
USP2 O75604 2/20 0.37
PLA2G2C Q5R387 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL28567440 0.81 DGKA (0.46) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL158387 0.79 MGLL (0.36) ALDH1A1
SCHEMBL8677575 0.76 DGKA (0.43) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL28257938 0.71 DGKA (0.56) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL111265 0.70 GRIK1 (0.43) ALDH1A1CYP3A4
SCHEMBL31683702 0.69 LMNA (0.48) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL30531662 0.69 LMNA (0.48) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL28113653 0.69 LMNA (0.48) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL320232 0.69 LMNA (0.48) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL3635596 0.69 LMNA (0.48) DGKAKDM4EDUSP3MEN1KMT2A

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
WO-2010138376-A1 ENHANCED EXPANDED POLYSTYRENE FOAM INSULATION NOVA CHEMICALS INC. (US) 2010-12-02 WO disclosed