SCHEMBL1521368

SCHEMBL1521368

CO[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@H](O)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 5/20 0.52
LGALS4 P56470 4/20 0.52
LGALS9 O00182 1/20 0.49
LGALS1 P09382 1/20 0.49
LGALS7; LGALS7B P47929 1/20 0.49
PTPN1 P18031 5/20 0.48
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
POLB P06746 1/20 0.45
KMT2A Q03164 1/20 0.45
LGALS8 O00214 2/20 0.45
ALDH1A1 P00352 3/20 0.45
PTPN2 P17706 1/20 0.43
PTPN11 Q06124 1/20 0.43
HTT P42858 1/20 0.43
SYNJ2 O15056 3/20 0.43

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
SCHEMBL12807943 1.00 LGALS3 (0.52) LGALS3LGALS4LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL1682156 1.00 LGALS3 (0.52) LGALS3LGALS4LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL1682180 1.00 LGALS3 (0.52) LGALS3LGALS4LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL9545439 1.00 LGALS3 (0.52) LGALS3LGALS4LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL12595600 1.00 LGALS3 (0.52) LGALS3LGALS4LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL24192986 1.00 LGALS3 (0.52) LGALS3LGALS4LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL14413230 1.00 LGALS3 (0.52) LGALS3LGALS4LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL19869143 1.00 LGALS3 (0.52) LGALS3LGALS4LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL7150482 0.93 LGALS8 (0.53) LGALS3LGALS4LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL8658236 0.93 LGALS3 (0.46) LGALS3LGALS4LGALS9LGALS1LGALS7; LGALS7B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8845999-B2 Tracers for monitoring the activity of sodium/glucose cotransporters in health and disease THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-09-30 US disclosed
US-7906460-B2 Active-site engineering of nucleotidylyltransferases and general enzymatic methods for the synthesis of natural and “unnatural” UDP- and TDP-nucleotide sugars SLOAN-KETTERING INSTITUTE FOR CANCER (US) 2011-03-15 US disclosed
US-20100008856-A1 TRACERS FOR MONITORING THE ACTIVITY OF SODIUM/GLUCOSE COTRANSPORTERS IN HEALTH AND DISEASE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-01-14 US disclosed
US-20070178487-A1 ACTIVE-SITE ENGINEERING OF NUCLEOTIDYLYLTRANSFERASES AND GENERAL ENZYMATIC METHODS FOR THE SYNTHESIS OF NATURAL AND \"UNNATURAL\" UDP- AND TDP-NUCLEOTIDE SUGARS WISCONSIN ALUMNI RESEARCH FOUNDATION 2007-08-02 US disclosed
US-7122359-B2 Active-site engineering of nucleotidylyltransferases and general enzymatic methods for the synthesis of natural and “unnatural” UDP- and TDP-nucleotide sugars SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2006-10-17 US disclosed
US-20030055235-A1 Active-site engineering of nucleotidylyltransferases and general enzymatic methods for the synthesis of natural and \"unnatural\" UDP- and TDP-nucleotide sugars SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH 2003-03-20 US disclosed
US-5474986-A Galabiose derivatives modified at 3* and anomeric positions SYMBICOM AKTIEBOLAG (SE) 1995-12-12 US disclosed
EP-0428605-B1 SYNTHETIC RECEPTOR ANALOGUES SYMBICOM AB (SE) 1994-10-19 EP 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 (3 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-20100008856-A1 TRACERS FOR MONITORING THE ACTIVITY OF SODIUM/GLUCOSE COTRANSPORTERS IN HEALTH AND DISEASE SLC5A1, SLC5A2, SLC2A1 LGALS3 336/4885LGALS4 356/4885LGALS9 417/4885
US-20030055235-A1 Active-site engineering of nucleotidylyltransferases and general enzymatic methods for the synthesis of natural and \"unnatural\" UDP- and TDP-nucleotide sugars PNP, NUDT14, ENTPD5 LGALS3 2760/4885LGALS4 2139/4885LGALS9 2952/4885
US-20070178487-A1 ACTIVE-SITE ENGINEERING OF NUCLEOTIDYLYLTRANSFERASES AND GENERAL ENZYMATIC METHODS FOR THE SYNTHESIS OF NATURAL AND \"UNNATURAL\" UDP- AND TDP-NUCLEOTIDE SUGARS PNP, NUDT14, NUDT5 LGALS3 2517/4885LGALS4 2034/4885LGALS9 2854/4885

“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.