SCHEMBL4074795

SCHEMBL4074795

CC(C)(C)[Si](OCc1cccc2ccc(CO[C@H]3[C@@H]4OC[C@@H]3O[C@H]4n3ccc(=O)[nH]c3=O)cc12)(c1ccccc1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
B4GALT1 P15291 4/20 0.33
DUT P33316 3/20 0.32
P2RY12 Q9H244 2/20 0.31
P2RY2 P41231 1/20 0.31
SMYD2 Q9NRG4 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
SCHEMBL4078642 0.84 B4GALT1 (0.34) B4GALT1P2RY12P2RY2
SCHEMBL4079078 0.84 B4GALT1 (0.36) B4GALT1P2RY12P2RY2
SCHEMBL4084059 0.84 B4GALT1 (0.35) MEN1KMT2AB4GALT1P2RY12P2RY2
SCHEMBL4078213 0.75 P2RY6 (0.33) DUTSMYD2
SCHEMBL4087677 0.71 B4GALT1 (0.35) MEN1KMT2AB4GALT1DUTSMYD2
SCHEMBL4078234 0.71 B4GALT1 (0.35) MEN1KMT2AB4GALT1DUTSMYD2
SCHEMBL4078224 0.70 P2RY6 (0.34) DUTP2RY2SMYD2
SCHEMBL4078222 0.70 P2RY6 (0.34) DUTP2RY2SMYD2
SCHEMBL4078216 0.70
SCHEMBL4084061 0.69

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-7569686-B1 Compounds and methods for synthesis of bicyclic nucleic acid analogs ISIS PHARMACEUTICALS, INC. (US) 2009-08-04 US disclosed