SCHEMBL9008026

SCHEMBL9008026

[CH2]c1ccc([C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.79
▸ PTPN1 P18031 1/20 0.57
▸ CYP2D6 P10635 1/20 0.51
▸ THRB P10828 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ CA12 O43570 12/20 0.49
▸ CA1 P00915 12/20 0.49
▸ CA2 P00918 12/20 0.49
▸ CA4 P22748 10/20 0.49
▸ CA5A P35218 10/20 0.49
▸ CA7 P43166 10/20 0.49
▸ CA5B Q9Y2D0 10/20 0.49
▸ CA9 Q16790 6/20 0.47
▸ CA6 P23280 4/20 0.47
▸ CA13 Q8N1Q1 4/20 0.47
▸ CA14 Q9ULX7 4/20 0.47
▸ LMNA P02545 2/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ NR3C1 P04150 1/20 0.47
▸ FYN P06241 1/20 0.47

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
SCHEMBL9007979 1.00 TSHR (0.79) TSHRPTPN1CYP2D6THRBHSD17B10
SCHEMBL9008023 1.00 TSHR (0.79) TSHRPTPN1CYP2D6THRBHSD17B10
SCHEMBL14009724 0.88 TSHR (0.81) TSHRPTPN1CYP2D6THRBHSD17B10
SCHEMBL14036045 0.88 TSHR (0.81) TSHRPTPN1CYP2D6THRBHSD17B10
SCHEMBL12762931 0.88 TSHR (1.00) TSHRPTPN1CYP2D6THRBHSD17B10
SCHEMBL4958429 0.87 TSHR (0.79) TSHRPTPN1CYP2D6THRBHSD17B10
SCHEMBL4620499 0.87 TSHR (0.79) TSHRPTPN1CYP2D6THRBHSD17B10
SCHEMBL16318304 0.87 TSHR (0.79) TSHRPTPN1CYP2D6THRBHSD17B10
SCHEMBL3482641 0.87 TSHR (0.79) TSHRPTPN1CYP2D6THRBHSD17B10
SCHEMBL14206852 0.87 TSHR (0.79) TSHRPTPN1CYP2D6THRBHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0511917-B1 Glycosylated prodrugs, process for their preparation and uses thereof HOECHST SA LAB (FR) 1996-10-23 — — EP claimed
WO-1992019639-A1 GLYCOSYLATED PRODRUGS, METHOD OF PREPARATION AND USE LABORATOIRES HOECHST (FR) 1992-11-12 — — WO claimed
EP-0511917-A1 Glycosylated prodrugs, process for their preparation and uses thereof LABORATOIRES HOECHST S.A. (FR) 1992-11-04 — — EP claimed
EP-0511917-B1 Glycosylated prodrugs, process for their preparation and uses thereof HOECHST SA LAB (FR) 1996-10-23 — — EP disclosed
WO-1992019639-A1 GLYCOSYLATED PRODRUGS, METHOD OF PREPARATION AND USE LABORATOIRES HOECHST (FR) 1992-11-12 — — WO disclosed
EP-0511917-A1 Glycosylated prodrugs, process for their preparation and uses thereof LABORATOIRES HOECHST S.A. (FR) 1992-11-04 — — EP disclosed
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