SCHEMBL16359392

SCHEMBL16359392

CC(=O)NC1C(OCCOCCOCCNC(=O)CCOCC(N)(COCCC=O)COCCC(=O)NCCOCCOCCOC2OC(CO)C(O)C(O)C2NC(C)=O)OC(CO)C(O)C1O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.46
▸ MDK P21741 3/20 0.46
▸ LGALS3 P17931 3/20 0.43
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ LGALS8 O00214 1/20 0.39
▸ LGALS4 P56470 1/20 0.39
▸ B4GALT1 P15291 1/20 0.37
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ CD69 Q07108 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL16359449 0.94 MAPK1 (0.52) MAPK1MDKLGALS3MEN1KMT2A
SCHEMBL13671600 0.93 MDK (0.43) MAPK1MDKLGALS3MEN1KMT2A
SCHEMBL24792570 0.89 MAPK1 (0.46) MAPK1MDKLGALS3MEN1KMT2A
SCHEMBL10229987 0.87 MAPK1 (0.53) MAPK1MDKLGALS3MEN1KMT2A
SCHEMBL21189935 0.87 MAPK1 (0.53) MAPK1MDKLGALS3MEN1KMT2A
SCHEMBL16359487 0.86 MDK (0.45) MAPK1MDKLGALS3MEN1KMT2A
SCHEMBL16358004 0.86 MAPK1 (0.51) MAPK1MDKLGALS3MEN1KMT2A
SCHEMBL26187782 0.86 MAPK1 (0.53) MAPK1MDKLGALS3MEN1KMT2A
SCHEMBL18972884 0.85 MAPK1 (0.53) MAPK1MDKLGALS3MEN1KMT2A
SCHEMBL23322820 0.85 MAPK1 (0.51) MAPK1MDKLGALS3MEN1KMT2A

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-2009126933-A2 SITE-SPECIFIC DELIVERY OF NUCLEIC ACIDS BY COMBINING TARGETING LIGANDS WITH ENDOSOMOLYTIC COMPONENTS ALNYLAM PHARMACEUTICALS, INC. (US) 2009-10-15 — — WO disclosed
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