SCHEMBL12202038

SCHEMBL12202038

CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC(=O)N[C@@H](COC1OC(COCc2ccccc2)C(OCc2ccccc2)C(OCc2ccccc2)C1OCc1ccccc1)[C@H](O)[C@H](O)CCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 11/20 0.46
▸ CDC25B P30305 9/20 0.46
▸ NT5E P21589 1/20 0.43
▸ PTPN2 P17706 6/20 0.42
▸ PTPN6 P29350 5/20 0.42
▸ PTPN11 Q06124 5/20 0.42
▸ TACR1 P25103 2/20 0.40
▸ SELP P16109 1/20 0.39
▸ CDC25A P30304 1/20 0.39

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
SCHEMBL12202034 0.94 PTPN1 (0.46) PTPN1CDC25BNT5EPTPN2PTPN6
SCHEMBL12202025 0.92 PTPN1 (0.45) PTPN1CDC25BNT5EPTPN2PTPN6
SCHEMBL12202028 0.92 PTPN1 (0.45) PTPN1CDC25BNT5EPTPN2PTPN6
SCHEMBL12202036 0.91 SELP (0.45) PTPN1CDC25BNT5EPTPN2PTPN6
SCHEMBL12202042 0.89 PTPN1 (0.45) PTPN1CDC25BNT5EPTPN2PTPN6
SCHEMBL12202041 0.89 PTPN1 (0.45) PTPN1CDC25BNT5EPTPN2PTPN6
SCHEMBL12202035 0.87 PTPN1 (0.47) PTPN1CDC25BNT5EPTPN2PTPN6
SCHEMBL12202032 0.87 PTPN1 (0.44) PTPN1CDC25BNT5EPTPN2PTPN6
SCHEMBL12202027 0.86 PTPN1 (0.44) PTPN1CDC25BNT5EPTPN2PTPN6
SCHEMBL12197588 0.86 SELP (0.43) PTPN1CDC25BNT5EPTPN2PTPN6

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-8034908-B2 Glycolipids and synthetic method thereof as well as their synthetic intermediates, and synthetic method thereof JAPAN AS REPRESENTED BY PRESIDENT OF NATIONAL CENTER OF NEUROLOGY AND PSYCHIATRY (JP) 2011-10-11 — — US disclosed
US-20100210828-A1 NEW GLYCOLIPIDS AND SYNTHETIC METHOD THEREOF AS WELL AS THEIR SYNTHETIC INTERMEDIATES, AND SYNTHETIC METHOD THEREOF JAPAN AS REPRESENTED BY THE PRESIDENT OF NATIONAL CENTER OF NEUROLOGY AND PSYCHIATRY (JP) 2010-08-19 — — US disclosed
US-7732583-B2 Glycolipids and synthetic method thereof as well as their synthetic intermediates, and synthetic intermediates, and synthetic method thereof JAPAN AS REPRESENTED BY PRESIDENT OF NATIONAL CENTER OF NEUROLOGY AND PSYCHIATRY (JP) 2010-06-08 — — 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-20100210828-A1 NEW GLYCOLIPIDS AND SYNTHETIC METHOD THEREOF AS WELL AS THEIR SYNTHETIC INTERMEDIATES, AND SYNTHETIC METHOD THEREOF SGMS1, UGCG, SGMS2 PTPN1 3627/4885CDC25B 2234/4885NT5E 1357/4885

“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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