SCHEMBL18394344

SCHEMBL18394344

[N-]=[N+]=NCCc1ccc(O[C@@H]2O[C@H](COCc3ccccc3)[C@H](O)[C@H](O)[C@H]2OCc2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 2/20 0.41
▸ GJB2 P29033 3/20 0.41
▸ SLC6A2 P23975 1/20 0.40
▸ SSTR4 P31391 2/20 0.38
▸ NT5E P21589 1/20 0.37
▸ GJA1 P17302 3/20 0.37
▸ PTPN1 P18031 4/20 0.36
▸ CDC25B P30305 4/20 0.36
▸ PTPN2 P17706 2/20 0.36
▸ PTPN6 P29350 2/20 0.36
▸ PTPN11 Q06124 2/20 0.36
▸ SSTR5 P35346 2/20 0.36

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
SCHEMBL18412650 1.00 LGALS3 (0.41) LGALS3GJB2SLC6A2SSTR4NT5E
SCHEMBL20243568 1.00 LGALS3 (0.41) LGALS3GJB2SLC6A2SSTR4NT5E
SCHEMBL18412635 0.92 LGALS3 (0.38) LGALS3GJB2SSTR4NT5EGJA1
SCHEMBL24059833 0.87 NT5E (0.47) LGALS3GJB2SSTR4NT5EPTPN1
SCHEMBL22013736 0.87 NT5E (0.47) LGALS3GJB2SSTR4NT5EPTPN1
SCHEMBL18394464 0.87 NT5E (0.47) LGALS3GJB2SSTR4NT5EPTPN1
SCHEMBL18394265 0.83 GJB2 (0.35) LGALS3GJB2SSTR4NT5EPTPN1
SCHEMBL22013739 0.83 GJB2 (0.35) LGALS3GJB2SSTR4NT5EPTPN1
SCHEMBL22991832 0.83 GJB2 (0.35) LGALS3GJB2SSTR4NT5EPTPN1
SCHEMBL20648775 0.82 LGALS3 (0.48) LGALS3GJB2SLC6A2SSTR4NT5E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220185838-A1 CARBOHYDRATE LIGANDS THAT BIND TO IGM ANTIBODIES AGAINST MYELIN-ASSOCIATED GLYCOPROTEIN UNIV BASEL (CH) 2022-06-16 — — US disclosed
US-11220523-B2 Carbohydrate ligands that bind to IgM antibodies against myelin-associated glycoprotein UNIVERSITÄT BASEL (CH) 2022-01-11 — — US disclosed
EP-3915999-A1 CARBOHYDRATE LIGANDS THAT BIND TO IGM ANTIBODIES AGAINST MYELIN-ASSOCIATED GLYCOPROTEIN Universität Basel (CH) 2021-12-01 — — EP disclosed
US-20210061838-A1 CARBOHYDRATE LIGANDS THAT BIND TO IGM ANTIBODIES AGAINST MYELIN-ASSOCIATED GLYCOPROTEIN UNIVERSITAET BASEL (CH) 2021-03-04 — — US disclosed
EP-3116887-B1 CARBOHYDRATE LIGANDS THAT BIND TO IGM ANTIBODIES AGAINST MYELIN-ASSOCIATED GLYCOPROTEIN UNIV BASEL (CH) 2021-02-17 — — EP disclosed
US-10662212-B2 Carbohydrate ligands that bind to IGM antibodies against myelin-associated glycoprotein UNIVERSITAT BASEL (CH) 2020-05-26 — — US disclosed
US-20180327438-A1 CARBOHYDRATE LIGANDS THAT BIND TO IGM ANTIBODIES AGAINST MYELIN-ASSOCIATED GLYCOPROTEIN UNIVERSITAET BASEL (CH) 2018-11-15 — — US disclosed
US-9994605-B2 Carbohydrate ligands that bind to IgM antibodies against myelin-associated glycoprotein UNIVERSITAET BASEL (CH) 2018-06-12 — — US disclosed
US-20170022239-A1 CARBOHYDRATE LIGANDS THAT BIND TO IGM ANTIBODIES AGAINST MYELIN-ASSOCIATED GLYCOPROTEIN UNIVERSITAET BASEL (CH) 2017-01-26 — — 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 (6 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-11220523-B2 Carbohydrate ligands that bind to IgM antibodies against myelin-associated glycoprotein MAG, PMP22, SIGLEC7 LGALS3 84/4885GJB2 991/4885SLC6A2 3983/4885
US-20220185838-A1 CARBOHYDRATE LIGANDS THAT BIND TO IGM ANTIBODIES AGAINST MYELIN-ASSOCIATED GLYCOPROTEIN MAG, PMP22, SIGLEC7 LGALS3 84/4885GJB2 991/4885SLC6A2 3983/4885
US-10662212-B2 Carbohydrate ligands that bind to IGM antibodies against myelin-associated glycoprotein MAG, PMP22, SIGLEC7 LGALS3 87/4885GJB2 875/4885SLC6A2 3953/4885
US-20210061838-A1 CARBOHYDRATE LIGANDS THAT BIND TO IGM ANTIBODIES AGAINST MYELIN-ASSOCIATED GLYCOPROTEIN MAG, PMP22, SIGLEC7 LGALS3 84/4885GJB2 991/4885SLC6A2 3983/4885
US-20170022239-A1 CARBOHYDRATE LIGANDS THAT BIND TO IGM ANTIBODIES AGAINST MYELIN-ASSOCIATED GLYCOPROTEIN MAG, PMP22, SIGLEC7 LGALS3 84/4885GJB2 991/4885SLC6A2 3983/4885
US-20180327438-A1 CARBOHYDRATE LIGANDS THAT BIND TO IGM ANTIBODIES AGAINST MYELIN-ASSOCIATED GLYCOPROTEIN MAG, PMP22, SIGLEC7 LGALS3 87/4885GJB2 875/4885SLC6A2 3953/4885

“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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