SCHEMBL19631111

SCHEMBL19631111

CCCCCCCCCOC(=O)CCCCCCCN(CCCCCCCCOC(CCCCCCCC)CCCCCCCC)CC(O)CO

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
DUSP3 P51452 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
LMNA P02545 1/20 0.49
DNM1 Q05193 1/20 0.44
DGKA P23743 2/20 0.44
PRKCA P17252 3/20 0.41
PRKCE Q02156 1/20 0.41
PRKCQ Q04759 1/20 0.41
PRKCD Q05655 1/20 0.41
CNR2 P34972 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL22645880 0.91 PRKCA (0.50) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL18665302 0.91 PRKCA (0.50) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL25067341 0.91 PRKCA (0.50) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL21842864 0.91 KDM4E (0.58) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL29323958 0.89 MAPT (0.47) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL24372245 0.88 LMNA (0.46) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL23314097 0.86 DNM1 (0.48) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL23794921 0.86 DNM1 (0.48) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL23314027 0.86 DNM1 (0.48) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL19636523 0.86 DNM1 (0.48) 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
WO-2017201349-A1 POLYNUCLEOTIDES ENCODING CITRIN FOR THE TREATMENT OF CITRULLINEMIA TYPE 2 MODERNATX, INC. (US) 2017-11-23 WO disclosed