SCHEMBL7704282

SCHEMBL7704282

CC1(C)COC(=O)C1OC(=O)O

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSV O60911 1/20 0.41
CTSL P07711 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
AR P10275 3/20 0.36

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
SCHEMBL7558920 0.87 CTSV (0.41) CTSVCTSLCTSSCTSKAR
SCHEMBL5685473 0.85 CTSV (0.38) CTSVCTSLCTSSCTSKAR
SCHEMBL5063468 0.85 CTSV (0.38) CTSVCTSLCTSSCTSKAR
SCHEMBL8241182 0.85 CTSV (0.38) CTSVCTSLCTSSCTSKAR
SCHEMBL4813603 0.84 AR (0.39) CTSVCTSLCTSSCTSKAR
SCHEMBL22356284 0.84 CTSV (0.38) CTSVCTSLCTSSCTSKAR
SCHEMBL22355974 0.84 CTSV (0.38) CTSVCTSLCTSSCTSKAR
SCHEMBL21684450 0.82 CTSV (0.37) CTSVCTSLCTSSCTSKAR
SCHEMBL13705801 0.81 CTSV (0.41) CTSVCTSLCTSSCTSKAR
SCHEMBL2754867 0.81 AR (0.37) CTSVCTSLCTSSCTSKAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6469193-B1 THREE COMPONENT COUPLINGS OF ALIPHATIC ALCOHOLS, ALKYL HALIDES AND CARBON DIOXIDE IN THE PRESENCE OF CESIUM CARBONATE AND TETRABUTYLAMMONIUM IODIDE UNIVERSITY OF SOUTH FLORIDA 2002-10-22 US disclosed
WO-2000050376-A9 EFFICIENT SYNTHESIS OF ALKYL CARBONATES UNIV SOUTH FLORIDA (US) 2001-10-11 WO disclosed
WO-2000050376-A2 EFFICIENT SYNTHESIS OF ALKYL CARBONATES UNIVERSITY OF SOUTH FLORIDA (US) 2000-08-31 WO disclosed