SCHEMBL10328199

SCHEMBL10328199

COc1ccc(C2(O)OC(COCc3ccccc3)[C@@H](C)C(OCc3ccccc3)[C@H]2OCc2ccccc2)cc1C=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 3/20 0.38
PTPN1 P18031 7/20 0.34
TACR2 P21452 2/20 0.33
SSTR1 P30872 1/20 0.33
SSTR2 P30874 1/20 0.33
SSTR4 P31391 1/20 0.33
SSTR3 P32745 1/20 0.33
SSTR5 P35346 1/20 0.33
PTPN2 P17706 3/20 0.32
PTPN11 Q06124 3/20 0.32
NT5E P21589 1/20 0.32
EDNRA P25101 2/20 0.32
CDC25B P30305 5/20 0.31
PTPN6 P29350 2/20 0.31
TUBB1 Q9H4B7 1/20 0.31
EDNRB P24530 1/20 0.31
FKBP1A P62942 1/20 0.31

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
SCHEMBL14617865 1.00 ERN1 (0.38) ERN1PTPN1TACR2SSTR1SSTR2
SCHEMBL2087673 0.94 ERN1 (0.39) ERN1PTPN1TACR2SSTR1SSTR2
SCHEMBL16090884 0.91 ERN1 (0.39) ERN1EDNRATUBB1EDNRB
SCHEMBL10177099 0.86 ERN1 (0.39) ERN1EDNRATUBB1EDNRB
SCHEMBL16727618 0.84 ERN1 (0.40) ERN1EDNRATUBB1EDNRB
SCHEMBL10328080 0.83 GJB2 (0.33) PTPN1TACR2SSTR1SSTR2SSTR4
SCHEMBL14617864 0.83 GJB2 (0.33) PTPN1TACR2SSTR1SSTR2SSTR4
SCHEMBL16727619 0.83 GJB2 (0.33) PTPN1TACR2SSTR1SSTR2SSTR4
SCHEMBL2089094 0.77 PTPN1 (0.35) PTPN1TACR2SSTR1SSTR2SSTR4
SCHEMBL18511211 0.77 PTPN1 (0.35) PTPN1TACR2SSTR1SSTR2SSTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120178680-A1 GLYCOSIDE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2012-07-12 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-20120178680-A1 GLYCOSIDE DERIVATIVES AND USES THEREOF SLC5A1, SLC5A2, SLC2A1 ERN1 2914/4885PTPN1 723/4885TACR2 2146/4885

“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.