SCHEMBL1029965

SCHEMBL1029965

c1ccc(COC[C@H]2O[C@@H](Sc3ccccc3)[C@H](OCc3ccccc3)[C@@H](OCc3ccccc3)[C@@H]2OCc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 1/20 0.47
▸ SSTR1 P30872 1/20 0.46
▸ SSTR2 P30874 1/20 0.46
▸ SSTR4 P31391 1/20 0.46
▸ SSTR3 P32745 1/20 0.46
▸ SSTR5 P35346 1/20 0.46
▸ NT5E P21589 1/20 0.44
▸ PTPN1 P18031 8/20 0.44
▸ CDC25B P30305 6/20 0.44
▸ TACR2 P21452 2/20 0.44
▸ PTPN2 P17706 3/20 0.43
▸ PTPN11 Q06124 3/20 0.43
▸ PTPN6 P29350 2/20 0.42
▸ BCHE P06276 1/20 0.41
▸ ACHE P22303 1/20 0.41
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA9 Q16790 1/20 0.40

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
SCHEMBL8137175 1.00 HTR1A (0.47) HTR1ASSTR1SSTR2SSTR4SSTR3
SCHEMBL1170781 1.00 HTR1A (0.47) HTR1ASSTR1SSTR2SSTR4SSTR3
SCHEMBL16237994 1.00 HTR1A (0.47) HTR1ASSTR1SSTR2SSTR4SSTR3
SCHEMBL14429227 1.00 HTR1A (0.47) HTR1ASSTR1SSTR2SSTR4SSTR3
SCHEMBL5515020 1.00 HTR1A (0.47) HTR1ASSTR1SSTR2SSTR4SSTR3
SCHEMBL18464593 1.00 HTR1A (0.47) HTR1ASSTR1SSTR2SSTR4SSTR3
SCHEMBL24645797 0.99 HTR1A (0.48) HTR1ASSTR1SSTR2SSTR4SSTR3
SCHEMBL21020652 0.99 HTR1A (0.48) HTR1ASSTR1SSTR2SSTR4SSTR3
SCHEMBL7027519 0.92 SSTR4 (0.44) HTR1ASSTR1SSTR2SSTR4SSTR3
SCHEMBL5941739 0.91 SSTR4 (0.44) HTR1ASSTR1SSTR2SSTR4SSTR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110086767-A1 MUTANTS OF GLYCOSIDE HYDROLASES AND USES THEREOF FOR SYNTHESIZING COMPLEX OLIGOSACCHARIDES AND DISACCHARIDE INTERMEDIATES INSTITUT PASTEUR 2011-04-14 — — US disclosed
EP-2271752-A2 MUTANTS OF GLYCOSIDE HYDROLASES AND USES THEREOF FOR SYNTHESIZING COMPLEX OLIGOSACCHARIDES AND DISACCHARIDE INTERMEDIATES Institut Pasteur (FR) 2011-01-12 — — EP disclosed
WO-2009112950-A2 MUTANTS OF GLYCOSIDE HYDROLASES AND USES THEREOF FOR SYNTHESIZING COMPLEX OLIGOSACCHARIDES AND DISACCHARIDE INTERMEDIATES INSTITUT PASTEUR (FR) 2009-09-17 — — WO disclosed
EP-2100965-A1 Mutants of glycoside hydrolases and uses thereof for synthesizing complex oligosaccharides and disaccharide intermediates Institut Pasteur (FR) 2009-09-16 — — EP disclosed
US-5864022-A Process for the manufacture of 3-amino-substituted glycosylated bile acids INTERCARDIA, INC. (US) 1999-01-26 — — US disclosed
EP-0766690-A4 PROCESS FOR THE MANUFACTURE OF 3-AMINO-SUBSTITUTED GLYCOSYLATED BILE ACIDS TRANSCELL TECHNOLOGIES INC (US) 1998-12-30 — — EP disclosed
US-5731423-A OXIDATION TRANSCELL TECHNOLOGIES, INC. (US) 1998-03-24 — — US disclosed
US-5693770-A Process for the manufacture of 3-amino-substituted glycosylated bile acids TRANSCELL TECHNOLOGIES, INC. (US) 1997-12-02 — — US disclosed
EP-0766690-A1 PROCESS FOR THE MANUFACTURE OF 3-AMINO-SUBSTITUTED GLYCOSYLATED BILE ACIDS TRANSCELL TECHNOLOGIES, INC. (US) 1997-04-09 — — EP disclosed
WO-1996000230-A1 PROCESS FOR THE MANUFACTURE OF 3-AMINO-SUBSTITUTED GLYCOSYLATED BILE ACIDS TRANSCELL TECHNOLOGIES, INC. (US) 1996-01-04 — — WO 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-20110086767-A1 MUTANTS OF GLYCOSIDE HYDROLASES AND USES THEREOF FOR SYNTHESIZING COMPLEX OLIGOSACCHARIDES AND DISACCHARIDE INTERMEDIATES ENGASE, GALE, MGAM HTR1A 4643/4885SSTR1 4504/4885SSTR2 4496/4885

“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