SCHEMBL5309359

SCHEMBL5309359

CCCCc1ccc(OC(CC(NC)OS(C)(=O)=O)c2ccoc2)c2ccccc12

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.35

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
SCHEMBL16834368 0.84 SLC2A1 (0.41) SLC2A1
SCHEMBL3282 0.82 SLC2A1 (0.43) SLC2A1
SCHEMBL5083145 0.79 SLC6A4 (0.46)
SCHEMBL3758 0.66 SLC6A4 (0.41)
SCHEMBL9613975 0.60 SLC2A1 (0.49) SLC2A1
SCHEMBL8823285 0.60 CNR2 (0.48)
SCHEMBL30537734 0.60 CNR2 (0.48)
SCHEMBL14614385 0.60 SLC2A1 (0.47) SLC2A1
SCHEMBL28769919 0.60 SLC2A1 (0.57) SLC2A1
SCHEMBL27919116 0.58 IDO1 (0.47) SLC2A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007041677-A9 SOFT TISSUE IMPLANTS AND DRUG COMBINATION COMPOSITIONS, AND USE THEREOF COMBINATORX INC (US) 2007-05-31 WO disclosed
WO-2007041677-A2 SOFT TISSUE IMPLANTS AND DRUG COMBINATION COMPOSITIONS, AND USE THEREOF COMBINATORX, INCORPORATED (US) 2007-04-12 WO disclosed