SCHEMBL13241371

SCHEMBL13241371

B[C@@H]1O[C@H](CO)[C@H](OCC(C)C)C1O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LGALS8 O00214 3/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ LGALS3 P17931 1/20 0.31
▸ LGALS4 P56470 1/20 0.31
▸ MGAM O43451 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ MAPK1 P28482 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
SCHEMBL9968286 1.00 LGALS8 (0.31) LGALS8ALDH1A1THRBLGALS3LGALS4
SCHEMBL11912100 0.83 LGALS8 (0.42) LGALS8LGALS3LGALS4L3MBTL1
SCHEMBL14536556 0.81 MAPK1 (0.34) LGALS8LGALS3LGALS4L3MBTL1MAPK1
SCHEMBL9971203 0.81 MAPK1 (0.34) LGALS8LGALS3LGALS4L3MBTL1MAPK1
SCHEMBL15304344 0.81 MAPK1 (0.34) LGALS8LGALS3LGALS4L3MBTL1MAPK1
SCHEMBL25597683 0.78 GJB2 (0.38) LGALS8LGALS3LGALS4MAPK1
SCHEMBL14511583 0.77 L3MBTL1 (0.36) LGALS8LGALS3LGALS4L3MBTL1
SCHEMBL18750454 0.77 — —
SCHEMBL14691187 0.74 GAA (0.49) L3MBTL1
SCHEMBL19770590 0.74 GAA (0.49) L3MBTL1

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-7759471-B2 nucleotide monomer used to make protected RNA that has similar stability to the DNA molecule AGILENT TECHNOLOGIES, INC. (US) 2010-07-20 — — US disclosed
Send feedback