SCHEMBL3496162

SCHEMBL3496162

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.55
POLB P06746 2/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
PTPN1 P18031 4/20 0.50
PTPN2 P17706 1/20 0.47
PTPN11 Q06124 1/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA9 Q16790 1/20 0.47
ALDH1A1 P00352 1/20 0.46
LGALS9 O00182 1/20 0.45
LGALS1 P09382 1/20 0.45
LGALS3 P17931 1/20 0.45
LGALS7; LGALS7B P47929 1/20 0.45
GAPDH P04406 2/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 2/20 0.43
TMPRSS2 O15393 1/20 0.43
PDE5A O76074 1/20 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
SCHEMBL11061066 1.00 USP2 (0.55) USP2POLBMEN1KMT2APTPN1
SCHEMBL26801670 1.00 USP2 (0.55) USP2POLBMEN1KMT2APTPN1
SCHEMBL2493929 1.00 USP2 (0.55) USP2POLBMEN1KMT2APTPN1
SCHEMBL2493931 1.00 USP2 (0.55) USP2POLBMEN1KMT2APTPN1
SCHEMBL5707687 1.00 USP2 (0.55) USP2POLBMEN1KMT2APTPN1
SCHEMBL14274463 1.00 USP2 (0.55) USP2POLBMEN1KMT2APTPN1
SCHEMBL11726595 1.00 USP2 (0.55) USP2POLBMEN1KMT2APTPN1
SCHEMBL3272584 0.99 USP2 (0.54) USP2POLBMEN1KMT2APTPN1
SCHEMBL6022376 0.99 USP2 (0.54) USP2POLBMEN1KMT2APTPN1
SCHEMBL3663518 0.99 USP2 (0.54) USP2POLBMEN1KMT2APTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8389565-B2 Antidiabetic agents; controlling carbohydrate metabolism SIMON FRASER UNIVERSITY (CA) 2013-03-05 US disclosed
US-8389565-B2 Antidiabetic agents; controlling carbohydrate metabolism SIMON FRASER UNIVERSITY (CA) 2013-03-05 US disclosed
US-20100210833-A1 METHOD OF PRODUCING NUCLEOSIDES CILAG AG (CH) 2010-08-19 US disclosed
EP-2197892-A2 METHOD OF PRODUCING NUCLEOSIDES Cilag AG (CH) 2010-06-23 EP disclosed
WO-2009047314-A2 METHOD OF PRODUCING NUCLEOSIDES CILAG AG (CH) 2009-04-16 WO disclosed
US-20060229275-A1 Production method of 2-deoxy-L-ribofuranosyl chloride compound AJINOMOTO CO. INC (JP) 2006-10-12 US disclosed
EP-1705181-A2 Production method of 2-deoxy-L-ribofuranosyl chloride compound AJINOMOTO CO., INC. (JP) 2006-09-27 EP disclosed
US-20060094031-A1 Alpha-L-arabinofuranosidase histochemical reporter gene assay STOWERS INSTITUTE FOR MEDICAL RESEARCH 2006-05-04 US disclosed
JP-2000186098-A PRODUCTION OF A-76202 AND ITS ANALOGOUS COMPOUND SANKYO CO LTD 2000-07-04 JP disclosed
EP-0063481-B1 WATER-SOLUBLE ANTITUMOR, ANTIVIRAL AND IMMUNOSUPPRESSANT COMPOUNDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-10-17 EP disclosed
US-4464531-A ANTITUMOR AGENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-08-07 US disclosed
EP-0063481-A1 Water-soluble antitumor, antiviral and immunosuppressant compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-10-27 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 (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-20060094031-A1 Alpha-L-arabinofuranosidase histochemical reporter gene assay GUSB, FUCA1, ENGASE USP2 1246/4885POLB 2560/4885MEN1 4693/4885
US-20060229275-A1 Production method of 2-deoxy-L-ribofuranosyl chloride compound DCTD, DERA, HDHD5 USP2 1312/4885POLB 955/4885MEN1 4773/4885

“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.