SCHEMBL16631257

SCHEMBL16631257

C[C@H]1O[C@@H](c2cc3ccc[nH]c-3nc2=S)[C@@H](O)C1O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SELP P16109 2/20 0.33
SELL P14151 1/20 0.33
ADK P55263 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
SCHEMBL16631873 0.83 PYGL (0.43)
SCHEMBL16631650 0.75
SCHEMBL16631244 0.74 SELL (0.30) SELPSELLADK
SCHEMBL16631391 0.72 OPRK1 (0.32) SELPSELL
SCHEMBL18081651 0.70
SCHEMBL16631876 0.70 TSHR (0.32) SELPSELL
SCHEMBL16631647 0.70
SCHEMBL18081957 0.69 NR1I3 (0.41) ADK
SCHEMBL18080481 0.68 NR1I3 (0.35) ADK
SCHEMBL16631866 0.68 SLC5A2 (0.44)

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-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 WO disclosed