SCHEMBL13419004

SCHEMBL13419004

CO[C@@H]1OC(CO)[C@H](C)[C@@H](OC(C)=O)C1OC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LGALS8 O00214 7/20 0.44
▸ CYP2D6 P10635 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ F10 P00742 1/20 0.40
▸ BCHE P06276 1/20 0.39
▸ LGALS9 O00182 2/20 0.37
▸ MMP9 P14780 1/20 0.36
▸ MMP12 P39900 1/20 0.36
▸ PRKCA P17252 2/20 0.36
▸ PRKD3 O94806 1/20 0.36
▸ PRKCG P05129 1/20 0.36
▸ PRKCB P05771 1/20 0.36
▸ PRKCH P24723 1/20 0.36
▸ PRKCE Q02156 1/20 0.36
▸ PRKCQ Q04759 1/20 0.36
▸ PRKCD Q05655 1/20 0.36
▸ PRKD1 Q15139 1/20 0.36
▸ CD69 Q07108 1/20 0.36
▸ CA2 P00918 1/20 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
SCHEMBL12410177 1.00 LGALS8 (0.44) LGALS8CYP2D6THRBHSD17B10F10
SCHEMBL13658767 0.90 LGALS8 (0.44) LGALS8CYP2D6THRBHSD17B10F10
SCHEMBL14179221 0.90 OGA (0.43) LGALS8CYP2D6THRBHSD17B10PRKCA
SCHEMBL10041437 0.88 LGALS8 (0.56) LGALS8CYP2D6THRBHSD17B10LGALS9
SCHEMBL13658762 0.88 LGALS8 (0.49) LGALS8CYP2D6THRBHSD17B10F10
SCHEMBL12021728 0.87 CYP2D6 (0.40) LGALS8CYP2D6THRBHSD17B10F10
SCHEMBL20109868 0.87 CYP2D6 (0.40) LGALS8CYP2D6THRBHSD17B10F10
SCHEMBL14428890 0.87 CYP2D6 (0.49) LGALS8CYP2D6THRBHSD17B10F10
SCHEMBL13387463 0.87 CYP2D6 (0.49) LGALS8CYP2D6THRBHSD17B10F10
SCHEMBL22034630 0.87 CYP2D6 (0.49) LGALS8CYP2D6THRBHSD17B10F10

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
US-7671193-B2 Improving heat resistant and optically protective properties of cellulose acetate; liquid crystal displays DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2010-03-02 — — US disclosed
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