SCHEMBL14985186

SCHEMBL14985186

CC1(I)C[C@H](O)C(CO)O1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 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
SCHEMBL4984741 0.77 PDE4D (0.31) PDE4D
SCHEMBL4984737 0.77 PDE4D (0.31) PDE4D
SCHEMBL7796924 0.77
SCHEMBL15424098 0.77 PDE4D (0.31) PDE4D
SCHEMBL6447297 0.77 PDE4D (0.31) PDE4D
SCHEMBL24025862 0.77 PDE4D (0.31) PDE4D
SCHEMBL12899666 0.75 GAA (0.31) PDE4D
SCHEMBL7788347 0.75
SCHEMBL21842390 0.75 PDE4D (0.31) PDE4D
SCHEMBL7797759 0.75

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-2013078138-A1 PROTON NMR SPECTROSCOPY FOR BIOCHEMICAL SCREENING OSI Pharmaceuticals, LLC (US) 2013-05-30 WO disclosed