SCHEMBL20473799

SCHEMBL20473799

CC(=O)OC1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.62
▸ PTPN1 P18031 11/20 0.58
▸ CDC25B P30305 8/20 0.58
▸ PTPN2 P17706 6/20 0.54
▸ PTPN11 Q06124 5/20 0.54
▸ PTPN6 P29350 4/20 0.54
▸ SSTR1 P30872 1/20 0.54
▸ SSTR2 P30874 1/20 0.54
▸ SSTR4 P31391 1/20 0.54
▸ SSTR3 P32745 1/20 0.54
▸ SSTR5 P35346 1/20 0.54
▸ TACR2 P21452 2/20 0.49

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
SCHEMBL5959877 1.00 NT5E (0.62) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL16267818 1.00 NT5E (0.62) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL4107734 1.00 NT5E (0.62) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL8359080 1.00 NT5E (0.62) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL8359084 1.00 NT5E (0.62) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL8579200 1.00 NT5E (0.62) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL14120091 1.00 NT5E (0.62) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL4107740 1.00 NT5E (0.62) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL16267817 1.00 NT5E (0.62) NT5EPTPN1CDC25BPTPN2PTPN11
SCHEMBL15822609 1.00 NT5E (0.62) NT5EPTPN1CDC25BPTPN2PTPN11

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-10543223-B2 Mannose derivatives useful for treating pathologies associated with adherent E. coli ENTEROME (FR) 2020-01-28 — — US disclosed
EP-3331893-B1 MANNOSE DERIVATIVES USEFUL FOR TREATING PATHOLOGIES ASSOCIATED WITH ADHERENT E. COLI ENTEROME (FR) 2019-05-22 — — EP disclosed
US-20180235991-A1 MANNOSE DERIVATIVES USEFUL FOR TREATING PATHOLOGIES ASSOCIATED WITH ADHERENT E. COLI NANTES UNIVERSITE (FR) 2018-08-23 — — 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 (2 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-20180235991-A1 MANNOSE DERIVATIVES USEFUL FOR TREATING PATHOLOGIES ASSOCIATED WITH ADHERENT E. COLI FPR3, CCR3, RXFP3 NT5E 4124/4885PTPN1 3404/4885CDC25B 4489/4885
US-10543223-B2 Mannose derivatives useful for treating pathologies associated with adherent E. coli FPR3, CCR3, RXFP3 NT5E 4124/4885PTPN1 3404/4885CDC25B 4489/4885

“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.

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