SCHEMBL1156091

SCHEMBL1156091

CS(=O)(=O)n1cc(C=O)cc1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELAVL1 Q15717 1/20 0.38
ALDH1A1 P00352 3/20 0.36
CYP2A6 P11509 1/20 0.36
ALOX5 P09917 1/20 0.35
MAPT P10636 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
LMNA P02545 1/20 0.33
PTGS2 P35354 7/20 0.33
PTGS1 P23219 1/20 0.33
BRD4 O60885 1/20 0.33
MAOA P21397 1/20 0.32
NAT1 P18440 1/20 0.32

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
SCHEMBL1156254 0.83 ALOX5 (0.44) ALOX5PTGS2PTGS1
SCHEMBL1157055 0.83 ALDH1A1 (0.45) ELAVL1ALDH1A1MAPTLMNA
SCHEMBL1156716 0.81 MET (0.41) ALDH1A1ALOX5MAPTPTGS2PTGS1
SCHEMBL1156187 0.80 KDM4E (0.51) ALDH1A1MAPTCA1CA2LMNA
SCHEMBL1156533 0.80 RAPGEF4 (0.42) ALDH1A1MAPTBRD4
SCHEMBL1155962 0.77 ELAVL1 (0.45) ELAVL1ALDH1A1MAPTLMNAPTGS2
SCHEMBL1156775 0.77 KDM4E (0.34) ALDH1A1ALOX5MAPTLMNAPTGS2
SCHEMBL1156459 0.77 ALDH1A1 (0.54) ELAVL1ALDH1A1CYP2A6MAPTLMNA
SCHEMBL1156990 0.76 HTT (0.42) ALDH1A1MAPTLMNA
SCHEMBL1278335 0.76 OGG1 (0.34) ALOX5MAPTPTGS2BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-1803709-B1 PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2013-01-02 EP disclosed
US-8048909-B2 Proton pump inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-11-01 US disclosed
EP-2336107-A2 Proton pump inhibitors Takeda Pharmaceutical Company Limited (JP) 2011-06-22 EP disclosed
US-20110028476-A1 PROTON PUMP INHIBITORS KAJINO MASAHIRO 2011-02-03 US 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-1803709-A1 PROTON PUMP INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2007-07-04 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 (4 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 ELAVL1 4799/4885ALDH1A1 2529/4885CYP2A6 185/4885
US-10308605-B2 Proton pump inhibitors HRH2, HRH4, HRH1 ELAVL1 4820/4885ALDH1A1 2593/4885CYP2A6 209/4885
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 ELAVL1 3012/4885ALDH1A1 1764/4885CYP2A6 344/4885
US-20110028476-A1 PROTON PUMP INHIBITORS HRH2, HRH4, CYP2C19 ELAVL1 4798/4885ALDH1A1 2505/4885CYP2A6 186/4885

“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.