SCHEMBL14563307

SCHEMBL14563307

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

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
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
PRKCA P17252 1/20 0.43
DGKA P23743 1/20 0.37
FAAH O00519 2/20 0.36
USP2 O75604 1/20 0.32
ADRB2 P07550 3/20 0.32
ADRB1 P08588 3/20 0.32
ADRB3 P13945 3/20 0.32
AR P10275 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
CNR2 P34972 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
SCHEMBL14727838 0.83 PRKCA (0.60) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL24436873 0.82 LMNA (0.44) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL14700446 0.80 KDM4E (0.43) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11231395 0.80 KDM4E (0.43) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL27051353 0.80 LMNA (0.43) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11306638 0.80 KDM4E (0.43) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL13217413 0.80 KDM4E (0.43) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL6056807 0.78 KDM4E (0.42) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL116867 0.78 LMNA (0.46) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL5519078 0.78 KDM4E (0.42) 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
EP-1762580-A2 Polyurethane dispersants THE LUBRIZOL CORPORATION (US) 2007-03-14 EP disclosed