SCHEMBL12899591

SCHEMBL12899591

C[C@@H]1C[C@@H](N)[C@@H](C(O)CO)O1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MANBA O00462 1/20 0.31
LMNA P02545 1/20 0.31
THRB P10828 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL12899598 1.00 MANBA (0.31) MANBALMNATHRBHIF1A
SCHEMBL12929760 0.80 MANBA (0.32) MANBALMNATHRBHIF1A
SCHEMBL12899636 0.78
SCHEMBL12899630 0.78
SCHEMBL12899617 0.70 TDP1 (0.32)
SCHEMBL6436137 0.69
SCHEMBL12899612 0.69 TDP1 (0.31)
SCHEMBL12929758 0.69 TDP1 (0.31)
SCHEMBL13522283 0.67
SCHEMBL18805892 0.67

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-7884202-B2 Nucleobases are perfluoroalkylated in a one step process with a perfluoroalkyl halide in the presence of a sulfoxide, a peroxide and an iron compound; useful as medicinal drugs, intermediates for medicinal drugs and agricultural chemicals TOSOH CORPORATION (JP) 2011-02-08 US disclosed