SCHEMBL1156714

SCHEMBL1156714

O=S(=O)(O)c1cnc(O)nc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
LMNA P02545 2/20 0.44
NAPRT Q6XQN6 1/20 0.41
TSHR P16473 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ING2 Q9H160 1/20 0.38
ALDH1A1 P00352 5/20 0.37
NT5E P21589 2/20 0.37
HSD17B10 Q99714 3/20 0.35
APLNR P35414 1/20 0.35
LCK P06239 1/20 0.34
FYN P06241 1/20 0.34
TDP1 Q9NUW8 3/20 0.33
HPGD P15428 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
POLB P06746 1/20 0.31
CYP2D6 P10635 1/20 0.31
NSD2 O96028 1/20 0.31

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
SCHEMBL13825980 0.79 KDM4E (0.50) KDM4ELMNANAPRTTSHRSMN1; SMN2
SCHEMBL12614860 0.77 ENPP2 (0.46) KDM4EAPLNRFYN
SCHEMBL4659249 0.77 KDM4E (0.59) KDM4ELMNANAPRTTSHRSMN1; SMN2
SCHEMBL6118994 0.77 KDM4E (0.48) KDM4ELMNANAPRTTSHRSMN1; SMN2
Hydrochloric Acid SCHEMBL28213025 0.75 KDM4E (0.57) KDM4ELMNANAPRTTSHRSMN1; SMN2
SCHEMBL30017884 0.73 KDM4E (0.61) KDM4ELMNANAPRTTSHRSMN1; SMN2
SCHEMBL3474987 0.73 KDM4E (0.61) KDM4ELMNANAPRTTSHRSMN1; SMN2
SCHEMBL8438731 0.72 KDM4E (0.65) KDM4ELMNANAPRTTSHRSMN1; SMN2
SCHEMBL10572753 0.72 ALDH1A1 (0.44) KDM4ELMNANAPRTTSHRSMN1; SMN2
SCHEMBL13359388 0.70 NAPRT (0.54) KDM4ELMNANAPRTTSHRSMN1; SMN2

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111484458-B Preparation method of 2-hydroxy-5-sulfonic pyrimidine 南京竹园医药科技有限公司 2022-12-27 CN claimed
CN-111484458-A Simple preparation method of 2-hydroxy-5-sulfo pyrimidine 南京竹园医药科技有限公司 2020-08-04 CN claimed
CN-111484458-B Preparation method of 2-hydroxy-5-sulfonic pyrimidine 南京竹园医药科技有限公司 2022-12-27 CN disclosed
CN-111484458-B Preparation method of 2-hydroxy-5-sulfonic pyrimidine 南京竹园医药科技有限公司 2022-12-27 CN disclosed
CN-111484458-A Simple preparation method of 2-hydroxy-5-sulfo pyrimidine 南京竹园医药科技有限公司 2020-08-04 CN disclosed
CN-111484458-A Simple preparation method of 2-hydroxy-5-sulfo pyrimidine 南京竹园医药科技有限公司 2020-08-04 CN disclosed
CN-111484458-A Simple preparation method of 2-hydroxy-5-sulfo pyrimidine 南京竹园医药科技有限公司 2020-08-04 CN disclosed
US-10308605-B2 Proton pump inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-06-04 US disclosed
EP-2336107-B1 Proton pump inhibitors TAKEDA PHARMACEUTICAL (JP) 2015-09-23 EP disclosed
US-20140343070-A1 PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-11-20 US disclosed
EP-2327692-B9 1-heterocyclylsulfonyl, 2-aminomethyl, 5-(hetero-)aryl substituted 1-H-pyrrole derivatives as acid secretion inhibitors TAKEDA PHARMACEUTICAL (JP) 2014-06-04 EP disclosed
CN-101300229-A 1-heterocyclylsulfonyl, 2-aminomethyl, 5- (hetero-) aryl substituted 1-h-pyrrole derivatives as acid secretion inhibitors TAKEDA PHARMACEUTICAL (JP) 2008-11-05 CN disclosed
US-20080139639-A1 3-amino(alkyl)-substituted pyrrole compounds such as N-methyl-1-[1-(phenylsulfonyl)-5-(3-thienyl)-1H-pyrrol-3-yl]methanamine; peptic ulcer, Zollinger-Ellison syndrome, gastritis, gastroesophageal reflux disease, gastric cancer, ulcer caused by non-steroidal anti-inflammatory agent (NSAID) use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-06-12 US disclosed
EP-1919865-A1 1-HETEROCYCLYLSULFONYL, 2-AMINOMETHYL, 5- (HETERO-) ARYL SUBSTITUTED 1-H-PYRROLE DERIVATIVES AS ACID SECRETION INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2008-05-14 EP disclosed
EP-1803709-A1 PROTON PUMP INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2007-07-04 EP disclosed
US-20070060623-A1 antiulcer agents; proton pump inhibitors; side effect reduction; 1-[4-fluoro-5-phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrol-3-yl]-N-methylmethanamine; superior acid secretion inhibitory effect; peptic ulcer, Zollinger-Ellison syndrome, reflux esophagitis, or symptomatic gastroesophageal reflux disease TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-15 US disclosed
WO-2007026916-A1 1-HETEROCYCLYLSULFONYL, 2-AMINOMETHYL, 5- (HETERO-) ARYL SUBSTITUTED 1-H-PYRROLE DERIVATIVES AS ACID SECRETION INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-08 WO disclosed
EP-1597256-A1 N-HETEROCYCLYL-SUBSTITUTED AMINO-THIAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS PFIZER INC. (US) 2005-11-23 EP disclosed
US-20050101595-A1 N-containing cycloalkyl-substituted amino-thiazole derivatives and pharmaceutical compositions for inhibiting cell proliferation and methods for their use PFIZER INC. 2005-05-12 US disclosed
WO-2004074283-A1 N-HETEROCYCLYL-SUBSTITUTED AMINO-THIAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS PFIZER INC. (US) 2004-09-02 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 (5 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-20140343070-A1 PROTON PUMP INHIBITORS HRH2, HRH4, CYP2C19 KDM4E 2114/4885LMNA 3729/4885NAPRT 666/4885
US-10308605-B2 Proton pump inhibitors HRH2, HRH4, HRH1 KDM4E 2305/4885LMNA 3457/4885NAPRT 937/4885
US-20080139639-A1 3-amino(alkyl)-substituted pyrrole compounds such as N-methyl-1-[1-(phenylsulfonyl)-5-(3-thienyl)-1H-pyrrol-3-yl]methanamine; peptic ulcer, Zollinger-Ellison syndrome, gastritis, gastroesophageal reflux disease, gastric cancer, ulcer caused by non-steroidal anti-inflammatory agent (NSAID) use PTGER1, PTGER3, NR3C1 KDM4E 887/4885LMNA 4165/4885NAPRT 1847/4885
US-20070060623-A1 antiulcer agents; proton pump inhibitors; side effect reduction; 1-[4-fluoro-5-phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrol-3-yl]-N-methylmethanamine; superior acid secretion inhibitory effect; peptic ulcer, Zollinger-Ellison syndrome, reflux esophagitis, or symptomatic gastroesophageal reflux disease HRH2, GIPR, HRH4 KDM4E 1622/4885LMNA 4243/4885NAPRT 2694/4885
US-20050101595-A1 N-containing cycloalkyl-substituted amino-thiazole derivatives and pharmaceutical compositions for inhibiting cell proliferation and methods for their use CCNI, MKI67, TK1 KDM4E 2240/4885LMNA 2515/4885NAPRT 366/4885

“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.