SCHEMBL45898

SCHEMBL45898

O=C(OCC1OC(OCCBr)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.52
PTPN2 P17706 1/20 0.49
PTPN11 Q06124 1/20 0.49
USP2 O75604 2/20 0.48
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
KMT2A Q03164 1/20 0.48
F11 P03951 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
TMPRSS2 O15393 1/20 0.47
PDE5A O76074 1/20 0.47
HMGCR P04035 1/20 0.47
CYP1A2 P05177 1/20 0.47
LCK P06239 1/20 0.47
FYN P06241 1/20 0.47
HSPD1 P10809 1/20 0.47
CYP2C9 P11712 1/20 0.47
CA6 P23280 1/20 0.47
TBXAS1 P24557 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
SCHEMBL35382 1.00 PTPN1 (0.52) PTPN1PTPN2PTPN11USP2MEN1
SCHEMBL34887 1.00 PTPN1 (0.52) PTPN1PTPN2PTPN11USP2MEN1
SCHEMBL19460956 0.92 PTPN1 (0.49) PTPN1PTPN2PTPN11USP2MEN1
SCHEMBL8350379 0.89 PTPN1 (0.53) PTPN1PTPN2PTPN11USP2MEN1
SCHEMBL8350378 0.89 PTPN1 (0.53) PTPN1PTPN2PTPN11USP2MEN1
SCHEMBL9179303 0.88 PTPN1 (0.52) PTPN1PTPN2PTPN11USP2MEN1
SCHEMBL14103196 0.88 PTPN1 (0.52) PTPN1PTPN2PTPN11USP2MEN1
SCHEMBL7980742 0.87 PTPN1 (0.51) PTPN1PTPN2PTPN11USP2MEN1
SCHEMBL8348286 0.87 PTPN1 (0.51) PTPN1PTPN2PTPN11USP2MEN1
SCHEMBL8348283 0.87 PTPN1 (0.51) PTPN1PTPN2PTPN11USP2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8772463-B2 Fluorescent dye-labeled glucose bioprobe, synthesis method and usage thereof SNU R&DB FOUNDATION (KR) 2014-07-08 US disclosed
US-8679854-B2 Fluorescent dye-labeled glucose bioprobe, synthesis method and usage thereof SNU & DB FOUNDATION (KR) 2014-03-25 US disclosed
US-8679854-B2 Fluorescent dye-labeled glucose bioprobe, synthesis method and usage thereof SNU & DB FOUNDATION (KR) 2014-03-25 US disclosed
US-8632749-B2 Two photon tracer, method for the preparation thereof and the use thereof in screening anticancer agents SNU R&DB FOUNDATION (KR) 2014-01-21 US disclosed
US-20110059022-A1 TWO PHOTON TRACER, METHOD FOR THE PREPARATION THEREOF AND THE USE THEREOF IN SCREENING ANTICANCER AGENTS SNU R&DB FOUNDATION (KR) 2011-03-10 US disclosed
US-20110059477-A1 FLUORESCENT DYE-LABELED GLUCOSE BIOPROBE, SYNTHESIS METHOD AND USAGE THEREOF SNU R&DB FOUNDATION (KR) 2011-03-10 US disclosed
US-20100105149-A1 FLUORESCENT DYE-LABELED GLUCOSE BIOPROBE, SYNTHESIS METHOD AND USAGE THEREOF SNU R&DB FOUNDATION (KR) 2010-04-29 US disclosed
US-20100105149-A1 FLUORESCENT DYE-LABELED GLUCOSE BIOPROBE, SYNTHESIS METHOD AND USAGE THEREOF SNU R&DB FOUNDATION (KR) 2010-04-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110059477-A1 FLUORESCENT DYE-LABELED GLUCOSE BIOPROBE, SYNTHESIS METHOD AND USAGE THEREOF OGA, UGGT1, GALE PTPN1 2831/4885PTPN2 4200/4885PTPN11 3426/4885
US-20100105149-A1 FLUORESCENT DYE-LABELED GLUCOSE BIOPROBE, SYNTHESIS METHOD AND USAGE THEREOF GALE, OGA, GNE PTPN1 3229/4885PTPN2 3854/4885PTPN11 3389/4885
US-20110059022-A1 TWO PHOTON TRACER, METHOD FOR THE PREPARATION THEREOF AND THE USE THEREOF IN SCREENING ANTICANCER AGENTS SLC2A2, SLC2A1, SLC2A9 PTPN1 4467/4885PTPN2 4040/4885PTPN11 4243/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.