SCHEMBL10274700

SCHEMBL10274700

CCCOCCOCCOCCNC(=O)C12CC(C)CC(CC(C)C1)C2

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 12/20 0.54
KDM4E B2RXH2 1/20 0.46
HTT P42858 1/20 0.46
POLB P06746 1/20 0.44
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.40
MEN1 O00255 1/20 0.38

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
SCHEMBL24758464 0.78 ALDH1A1 (0.50) EPHX2KDM4EHTTPOLBKMT2A
SCHEMBL7778488 0.77 KDM4E (0.57) EPHX2KDM4EHTTPOLBKMT2A
SCHEMBL15545516 0.76 HTT (0.55) EPHX2KDM4EHTTPOLBKMT2A
SCHEMBL6891227 0.73 ALDH1A1 (0.62) EPHX2KDM4EHTTPOLBKMT2A
SCHEMBL7778418 0.73 KDM4E (0.64) EPHX2KDM4EHTTPOLBKMT2A
SCHEMBL17702625 0.71 KMT2A (0.70) EPHX2KDM4EHTTPOLBKMT2A
SCHEMBL25561712 0.70 KDM4E (0.44) EPHX2KDM4EHTTPOLBKMT2A
SCHEMBL482692 0.69 ALDH1A1 (0.49) EPHX2KMT2ALMNAMEN1
SCHEMBL19116253 0.69 EPHX2 (0.86) EPHX2
SCHEMBL28504782 0.68 KDM4E (0.57) EPHX2KDM4EHTTPOLBKMT2A

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-2012006475-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2012-01-12 WO disclosed