SCHEMBL7147135

SCHEMBL7147135

CC(=O)CCC(=O)O[C@H]1[C@H]2OC(c3ccccc3)OC[C@H]2O[C@@H](Sc2ccc(C)cc2)[C@@H]1OC(=O)CCl

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
SELP P16109 1/20 0.30
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30
CA5A P35218 1/20 0.30
CA7 P43166 1/20 0.30
CA5B Q9Y2D0 1/20 0.30

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
SCHEMBL7151725 0.91 L3MBTL1 (0.40) L3MBTL1KMT2AMEN1SELP
SCHEMBL7151504 0.89 L3MBTL1 (0.40) L3MBTL1KMT2AMEN1
SCHEMBL7145164 0.89 L3MBTL1 (0.50) L3MBTL1KMT2AMEN1SELP
SCHEMBL7152041 0.87 KMT2A (0.46) L3MBTL1KMT2AMEN1
SCHEMBL7145822 0.87 L3MBTL1 (0.49) L3MBTL1KMT2AMEN1SELP
SCHEMBL7153859 0.85 L3MBTL1 (0.47) L3MBTL1KMT2AMEN1SELPCA12
SCHEMBL7154481 0.81 L3MBTL1 (0.45) L3MBTL1KMT2AMEN1
SCHEMBL7151724 0.80 L3MBTL1 (0.41) L3MBTL1KMT2AMEN1SELP
SCHEMBL7145157 0.78 L3MBTL1 (0.51) L3MBTL1KMT2AMEN1SELP
SCHEMBL19614247 0.76 L3MBTL1 (0.50) L3MBTL1KMT2AMEN1SELP

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-6538117-B1 Linear sequence of three or more glycosyl units linked to one another by glycosidic linkages; database of reactivity values for glycosyl donors THE SCRIPPS RESEARCH INSTITUTE 2003-03-25 US disclosed