SCHEMBL9053790

SCHEMBL9053790

CO[C@H]1O[C@H](COC(=O)C(C)C)C[C@H]1O

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TK1 P04183 1/20 0.34

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
SCHEMBL20976829 0.78 ALDH1A1 (0.31) —
SCHEMBL9053786 0.78 — —
SCHEMBL12174018 0.78 TK1 (0.36) TK1
SCHEMBL6933961 0.75 PDK1 (0.34) —
SCHEMBL21728820 0.75 PDK1 (0.34) —
SCHEMBL22911784 0.75 TK1 (0.38) TK1
SCHEMBL3240780 0.75 TK1 (0.35) TK1
SCHEMBL15948866 0.75 NPC1 (0.51) —
SCHEMBL10291118 0.74 G6PD (0.32) —
SCHEMBL6888988 0.73 CA12 (0.32) —

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-1996006851-A2 D-XYLOFURANOSE DERIVATIVES, METHOD OF PREPARING THEM, THEIR USE, AND NOVEL INTERMEDIATE COMPOUNDS FOR THE METHOD CHEMPROSA HOLDING AG (AT) 1996-03-07 — — WO disclosed
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