SCHEMBL247787

SCHEMBL247787

COc1ccc(COC[C@H]2O[C@@H](SC)[C@H](OCc3ccc(OC)cc3)[C@@H](OCc3ccc(OC)cc3)[C@H]2OCc2ccc(OC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GJB2 P29033 1/20 0.44
GJA1 P17302 1/20 0.44
SSTR4 P31391 6/20 0.42
SSTR1 P30872 2/20 0.40
SSTR2 P30874 2/20 0.40
SSTR3 P32745 2/20 0.40
SSTR5 P35346 2/20 0.40
HTR1A P08908 1/20 0.36
PTPN1 P18031 2/20 0.36
PTPN2 P17706 1/20 0.36
IDO1 P14902 2/20 0.36
AGXT P21549 2/20 0.36
APP P05067 2/20 0.35
TACR2 P21452 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
SCHEMBL8628196 0.88 GJB2 (0.43) GJB2GJA1SSTR4SSTR1SSTR2
SCHEMBL6809981 0.86 SSTR4 (0.49) GJB2GJA1SSTR4SSTR1SSTR2
SCHEMBL15377840 0.85 GJB2 (0.41) GJB2GJA1SSTR4SSTR1SSTR2
SCHEMBL5941739 0.84 SSTR4 (0.44) GJB2GJA1SSTR4SSTR1SSTR2
SCHEMBL9101113 0.82 SSTR4 (0.40) GJB2GJA1SSTR4SSTR1SSTR2
SCHEMBL8625319 0.82 GJB2 (0.41) GJB2GJA1SSTR4SSTR1SSTR2
SCHEMBL14747303 0.82 GJB2 (0.47) GJB2GJA1SSTR4SSTR1SSTR2
SCHEMBL5027889 0.81 GJB2 (0.51) GJB2GJA1SSTR4SSTR1SSTR2
SCHEMBL5027888 0.81 GJB2 (0.51) GJB2GJA1SSTR4SSTR1SSTR2
SCHEMBL17267495 0.80 GJB2 (0.46) GJB2GJA1SSTR4SSTR1SSTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9512158-B2 Enhanced immunogenicity of tumor associated antigens by addition of alphagal epitopes NEWLINK GENETICS CORPORATION (US) 2016-12-06 US disclosed
EP-2089051-B1 ENHANCED IMMUNOGENICITY OF TUMOR ASSOCIATED ANTIGENS BY ADDITION OF ALPHAGAL EPITOPES NEWLINK GENETICS (US) 2016-11-30 EP disclosed
US-9090643-B2 Enhanced immunogenicity of tumor associated antigens by addition of alphagal epitopes NEWLINK GENETICS CORPORATION (US) 2015-07-28 US disclosed
US-8916169-B2 Enhanced immunogenicity of tumor associated antigens by addition of alphagal epitopes NEWLINK GENETICS CORPORATION (US) 2014-12-23 US disclosed
US-20130178613-A1 ENHANCED IMMUNOGENICITY OF TUMOR ASSOCIATED ANTIGENS BY ADDITION OF ALPHAGAL EPITOPES NewLink Genetics Corp. (US) 2013-07-11 US disclosed
US-20130164319-A1 ENHANCED IMMUNOGENICITY OF TUMOR ASSOCIATED ANTIGENS BY ADDITION OF ALPHAGAL EPITOPES NewLink Genetics Corp. (US) 2013-06-27 US disclosed
US-20130164318-A1 ENHANCED IMMUNOGENICITY OF TUMOR ASSOCIATED ANTIGENS BY ADDITION OF ALPHAGAL EPITOPES NewLink Genetics Corp. (US) 2013-06-27 US disclosed
US-8357777-B2 Enhanced immunogenicity of tumor associated antigens by addition of αgal epitopes NEWLINK GENETICS (US) 2013-01-22 US disclosed
US-20120003251-A1 ENHANCED IMMUNOGENICITY OF TUMOR ASSOCIATED ANTIGENS BY ADDITION OF ALPHAGAL EPITOPES NEWLINK GENETICS (US) 2012-01-05 US disclosed
US-7998486-B2 Enhanced immunogenicity of tumor associated antigens by addition of alphaGal epitopes NEWLINK GENETICS CORPORATION (US) 2011-08-16 US disclosed
US-20090060930-A1 Enhanced immunogenicity of tumor associated antigens by addition of alphaGal epitopes NEWLINK GENETICS 2009-03-05 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 (5 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-20130164319-A1 ENHANCED IMMUNOGENICITY OF TUMOR ASSOCIATED ANTIGENS BY ADDITION OF ALPHAGAL EPITOPES ENGASE, FUT5, FUT6 GJB2 3987/4885GJA1 3114/4885SSTR4 2874/4885
US-20130178613-A1 ENHANCED IMMUNOGENICITY OF TUMOR ASSOCIATED ANTIGENS BY ADDITION OF ALPHAGAL EPITOPES ENGASE, FUT5, FUT6 GJB2 3987/4885GJA1 3114/4885SSTR4 2874/4885
US-20090060930-A1 Enhanced immunogenicity of tumor associated antigens by addition of alphaGal epitopes ENGASE, FUT5, FUT6 GJB2 3987/4885GJA1 3114/4885SSTR4 2874/4885
US-20120003251-A1 ENHANCED IMMUNOGENICITY OF TUMOR ASSOCIATED ANTIGENS BY ADDITION OF ALPHAGAL EPITOPES ENGASE, GALE, FUT5 GJB2 4221/4885GJA1 3373/4885SSTR4 2914/4885
US-20130164318-A1 ENHANCED IMMUNOGENICITY OF TUMOR ASSOCIATED ANTIGENS BY ADDITION OF ALPHAGAL EPITOPES ENGASE, FUT5, FUT6 GJB2 3987/4885GJA1 3114/4885SSTR4 2874/4885

“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.