SCHEMBL13360503

SCHEMBL13360503

CC(=O)COCCOCCNC(=O)C(N)C(C)C

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
CES2 O00748 1/20 0.36
CA2 P00918 5/20 0.36
DPP4 P27487 2/20 0.35
DPP8 Q6V1X1 2/20 0.35
DPP9 Q86TI2 2/20 0.35
DPP7 Q9UHL4 2/20 0.35
FAP Q12884 1/20 0.35
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TLR2 O60603 3/20 0.32
GLP1R P43220 3/20 0.32

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
SCHEMBL13328241 0.86 MEN1 (0.53) MEN1KMT2ACA2DPP4DPP8
SCHEMBL21106192 0.85 KMT2A (0.59) MEN1KMT2ACES2CA2POLB
SCHEMBL23568253 0.85 KMT2A (0.59) MEN1KMT2ACES2CA2POLB
SCHEMBL23559968 0.85 KMT2A (0.59) MEN1KMT2ACES2CA2POLB
SCHEMBL7300946 0.83 MEN1 (0.58) MEN1KMT2ACA2DPP4DPP8
SCHEMBL22375784 0.82 MEN1 (0.49) MEN1KMT2ACA2DPP4DPP8
SCHEMBL13029986 0.81 MEN1 (0.47) MEN1KMT2ACES2CA2DPP7
SCHEMBL25794016 0.81 KMT2A (0.53) MEN1KMT2ACES2POLBSMN1; SMN2
SCHEMBL24764090 0.81 MEN1 (0.54) MEN1KMT2ACES2CA2SMN1; SMN2
SCHEMBL19324447 0.80 MEN1 (0.52) MEN1KMT2ADPP4DPP8DPP9

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-7713944-B2 Oligomers comprising activated disulfides which bind to plasma proteins and their use for delivery to cells ISIS PHARMACEUTICALS, INC. (US) 2010-05-11 US disclosed