SCHEMBL5841546

SCHEMBL5841546

CC(=O)N[C@H]1[C@@H](OCc2ccccc2)O[C@H](CO)[C@@H](O)[C@@H]1OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAG P20916 1/20 0.55
▸ LGALS8 O00214 1/20 0.53
▸ SLC6A2 P23975 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ SSTR5 P35346 2/20 0.49
▸ SSTR1 P30872 1/20 0.49
▸ SSTR2 P30874 1/20 0.49
▸ SSTR4 P31391 1/20 0.49
▸ SSTR3 P32745 1/20 0.49
▸ HRAS P01112 1/20 0.49
▸ POLB P06746 2/20 0.49
▸ LGALS3 P17931 1/20 0.48
▸ MAPK1 P28482 1/20 0.47

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
SCHEMBL5841001 1.00 MAG (0.55) MAGLGALS8SLC6A2L3MBTL1SSTR5
SCHEMBL22204678 1.00 MAG (0.55) MAGLGALS8SLC6A2L3MBTL1SSTR5
SCHEMBL5841006 1.00 MAG (0.55) MAGLGALS8SLC6A2L3MBTL1SSTR5
SCHEMBL24351978 0.92 POLB (0.56) MAGLGALS8SLC6A2L3MBTL1HRAS
SCHEMBL7717946 0.91 MAG (0.58) MAGLGALS8SLC6A2L3MBTL1HRAS
SCHEMBL16153923 0.91 MAG (0.58) MAGLGALS8SLC6A2L3MBTL1HRAS
SCHEMBL542355 0.91 MAG (0.58) MAGLGALS8SLC6A2L3MBTL1HRAS
SCHEMBL7717956 0.91 MAG (0.58) MAGLGALS8SLC6A2L3MBTL1HRAS
SCHEMBL542353 0.91 MAG (0.58) MAGLGALS8SLC6A2L3MBTL1HRAS
SCHEMBL15143133 0.91 L3MBTL1 (0.50) MAGL3MBTL1SSTR5SSTR1SSTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7098195-B2 Fluorinated glucosamine analogs useful for modulating post-translational glycosylations on cells HEALTH RESEARCH, INC. (US) 2006-08-29 — — US disclosed
US-20040058888-A1 Methods for synthesis of alpha-d-gal (1~>3) gal-containing oligosaccharides ALCHEMIA PTY LTD. (AU) 2004-03-25 — — US disclosed
US-20030148997-A1 Fluorinated glucosamine analogs useful for modulating post-translational glycosylations on cells NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-08-07 — — US disclosed
EP-1257558-A1 METHODS FOR SYNTHESIS OF ALPHA-D-GAL (1- 3) GAL-CONTAINING OLIGOSACCHARIDES Alchemia Pty Ltd (AU) 2002-11-20 — — EP disclosed
WO-2001051499-A1 METHODS FOR SYNTHESIS OF α-D-GAL (1→3) GAL-CONTAINING OLIGOSACCHARIDES ALCHEMIA PTY LTD (AU) 2001-07-19 — — 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 (2 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-20030148997-A1 Fluorinated glucosamine analogs useful for modulating post-translational glycosylations on cells FUT5, FUT6, OGT MAG 314/4885LGALS8 98/4885SLC6A2 3485/4885
US-20040058888-A1 Methods for synthesis of alpha-d-gal (1~>3) gal-containing oligosaccharides B4GALT1, B3GAT3, FUT5 MAG 262/4885LGALS8 65/4885SLC6A2 4821/4885

“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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