SCHEMBL4750334

SCHEMBL4750334

O=C(CS(=O)(=O)OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.47
TDP1 Q9NUW8 4/20 0.47
MAPK1 P28482 3/20 0.47
HPGD P15428 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
CYP3A4 P08684 1/20 0.47
ALOX15 P16050 1/20 0.47
CES1 P23141 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
F2 P00734 1/20 0.47
HSD11B1 P28845 6/20 0.44
GSK3B P49841 2/20 0.44
HIF1A Q16665 2/20 0.44
TSHR P16473 1/20 0.44
TRPA1 O75762 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL6234524 0.81 LMNA (0.53) TDP1MAPK1HPGDKMT2ALMNA
SCHEMBL11213440 0.80 HSD11B1 (0.57) RECQLTDP1MAPK1KMT2AMAPT
SCHEMBL6660239 0.79 RECQL (0.53) RECQLTDP1MAPK1HPGDKMT2A
SCHEMBL17417729 0.78 KMT2A (0.52) TDP1MAPK1HPGDKMT2AMAPT
SCHEMBL6664422 0.78 KMT2A (0.52) RECQLTDP1MAPK1HPGDKMT2A
SCHEMBL6659940 0.76 RECQL (0.50) RECQLTDP1MAPK1HPGDKMT2A
SCHEMBL28310222 0.76 LMNA (0.53) TDP1MAPK1HPGDKMT2ALMNA
SCHEMBL1315543 0.76 LMNA (0.58) TDP1MAPK1KMT2AMAPTLMNA
SCHEMBL1516246 0.76 MAPK1 (0.58) RECQLTDP1MAPK1HPGDKMT2A
SCHEMBL6660055 0.75 RECQL (0.49) RECQLTDP1MAPK1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101356165-A Process for preparing gemcitabine and related intermediates CHEMAGIS LTD (IL) 2009-01-28 CN disclosed
WO-2008129530-A1 GEMCITABINE PRODUCTION PROCESS CHEMAGIS LTD. (IL) 2008-10-30 WO disclosed
US-20080262215-A1 GEMCITABINE PRODUCTION PROCESS CHEMAGIS LTD. (IL) 2008-10-23 US disclosed
WO-2007070804-A2 PROCESS FOR PREPARING GEMCITABINE AND ASSOCIATED INTERMEDIATES CHEMAGIS LTD. (IL) 2007-06-21 WO disclosed
EP-0732338-B1 2,2-Difluoro-3-carbamoyl ribose sulfonate compounds and process for the preparation of beta nucleosides LILLY CO ELI (US) 2002-05-15 EP disclosed
EP-0732338-A1 2,2-Difluoro-3-carbamoyl ribose sulfonate compounds and process for the preparation of beta nucleosides ELI LILLY AND COMPANY (US) 1996-09-18 EP disclosed
US-5521294-A 2,2-difluoro-3-carbamoyl ribose sulfonate compounds and process for the preparation of beta nucleosides ELI LILLY AND COMPANY (US) 1996-05-28 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-20080262215-A1 GEMCITABINE PRODUCTION PROCESS SAMHD1, DCK, DCTD RECQL 3675/4885TDP1 2174/4885MAPK1 3860/4885

“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.