SCHEMBL2605159

SCHEMBL2605159

CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@H](CO[C@H]1OC(COCc2ccccc2)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)C1OCc1ccccc1)NS(=O)(=O)c1ccccc1C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SELP P16109 5/20 0.46
▸ PTPN1 P18031 9/20 0.42
▸ CDC25B P30305 8/20 0.42
▸ SSTR1 P30872 1/20 0.39
▸ SSTR2 P30874 1/20 0.39
▸ SSTR4 P31391 1/20 0.39
▸ SSTR3 P32745 1/20 0.39
▸ SSTR5 P35346 1/20 0.39
▸ PTPN2 P17706 4/20 0.39
▸ PTPN6 P29350 4/20 0.39
▸ PTPN11 Q06124 4/20 0.39
▸ NT5E P21589 1/20 0.38
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37

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
SCHEMBL2605156 0.90 SELP (0.47) SELPPTPN1CDC25BSSTR1SSTR2
SCHEMBL2605162 0.89 SELP (0.45) SELPPTPN1CDC25BSSTR1SSTR2
SCHEMBL2605165 0.88 SELP (0.47) SELPPTPN1CDC25BSSTR1SSTR2
SCHEMBL2605158 0.84 SELP (0.41) SELPPTPN1CDC25BSSTR1SSTR2
SCHEMBL20019548 0.84 SELP (0.51) SELPPTPN1CDC25BSSTR1SSTR2
SCHEMBL2606625 0.83 SELP (0.35) SELPPTPN1CDC25BSSTR1SSTR2
SCHEMBL12202054 0.81 SELP (0.45) SELPPTPN1CDC25BSSTR1SSTR2
SCHEMBL12202043 0.81 SELP (0.52) SELPPTPN1CDC25BPTPN2PTPN6
SCHEMBL12202044 0.79 SELP (0.54) SELPPTPN1CDC25BPTPN2PTPN6
SCHEMBL12202053 0.79 SELP (0.49) SELPPTPN1CDC25BPTPN2PTPN6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163705-B2 Glycolipid and use thereof RIKEN (JP) 2012-04-24 — — US disclosed
US-20090221516-A1 NOVEL GLYCOLIPID AND USE THEREOF RIKEN (JP) 2009-09-03 — — 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 (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-20090221516-A1 NOVEL GLYCOLIPID AND USE THEREOF IL4, IL2, IL5 SELP 279/4885PTPN1 259/4885CDC25B 528/4885

“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.

Send feedback