SCHEMBL4185421

SCHEMBL4185421

COc1ccc(O[C@@H]2O[C@H](COCc3ccccc3)[C@@H](OC(=O)CCC(C)=O)[C@H](OCc3ccccc3)[C@H]2N2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FGF2 P09038 1/20 0.43
▸ MDK P21741 1/20 0.43
▸ NT5E P21589 1/20 0.40
▸ PTPN1 P18031 9/20 0.38
▸ PTPN2 P17706 5/20 0.38
▸ CDC25B P30305 6/20 0.37
▸ PTPN6 P29350 3/20 0.36
▸ PTPN11 Q06124 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ TNF P01375 1/20 0.35
▸ GJB2 P29033 1/20 0.35
▸ GJA1 P17302 1/20 0.35
▸ BCHE P06276 1/20 0.35
▸ LGALS3 P17931 1/20 0.35

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
SCHEMBL3756881 0.91 NT5E (0.43) NT5EPTPN1PTPN2CDC25BPTPN6
SCHEMBL27002581 0.91 NT5E (0.43) NT5EPTPN1PTPN2CDC25BPTPN6
SCHEMBL3756883 0.91 NT5E (0.43) NT5EPTPN1PTPN2CDC25BPTPN6
SCHEMBL4185420 0.90 PTPN1 (0.43) FGF2MDKNT5EPTPN1PTPN2
SCHEMBL4178365 0.88 NT5E (0.41) NT5EPTPN1PTPN2CDC25BPTPN6
SCHEMBL4165972 0.85 NT5E (0.41) NT5EPTPN1PTPN2CDC25BPTPN6
SCHEMBL3625228 0.84 LGALS3 (0.43) NT5EPTPN1PTPN2CDC25BPTPN6
SCHEMBL26506298 0.84 LGALS3 (0.43) NT5EPTPN1PTPN2CDC25BPTPN6
SCHEMBL3625232 0.84 LGALS3 (0.43) NT5EPTPN1PTPN2CDC25BPTPN6
SCHEMBL5011497 0.84 CYP3A4 (0.47) MAPTCYP3A4CYP2D6CYP2C19ALDH1A1

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-20090176970-A1 Preparation of Thiosugars and Their Use GLYCOFORM LIMITED (GB) 2009-07-09 — — US disclosed
EP-2007782-A2 THE PREPARATION OF THIOSUGARS AND THEIR USE Glycoform Limited (GB) 2008-12-31 — — EP disclosed
WO-2007091040-A2 THE PREPARATION OF THIOSUGARS AND THEIR USE GLYCOFORM LIMITED (GB) 2007-08-16 — — WO 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 (1 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-20090176970-A1 Preparation of Thiosugars and Their Use TST, TREH, FUT6 FGF2 3378/4885MDK 4335/4885NT5E 2113/4885

“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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