SCHEMBL1156433

SCHEMBL1156433

N#Cc1cccc(S(=O)(=O)n2cc(CCNC(=O)O)cc2-c2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 3/20 0.41
CTSG P08311 1/20 0.41
CMA1 P23946 1/20 0.41
PTGER1 P34995 1/20 0.38
PPME1 Q9Y570 3/20 0.38
KLKB1 P03952 1/20 0.38
ACLY P53396 2/20 0.38
CNR1 P21554 1/20 0.38
HTR6 P50406 1/20 0.37
ITGAV P06756 1/20 0.36
ABCB1 P08183 1/20 0.36
HPGD P15428 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
USP2 O75604 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36
LMNA P02545 1/20 0.35

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
SCHEMBL1156830 0.87 NAMPT (0.43) KAT6AUSP2CYP1A2CYP3A4CLK4
SCHEMBL1156448 0.85 KMT2A (0.43) HTR6HPGD
SCHEMBL5006365 0.83 NAMPT (0.36) KAT6ACTSGCMA1PTGER1PPME1
SCHEMBL1156454 0.83 GAA (0.41) LMNA
SCHEMBL1580309 0.82 CTSG (0.44) KAT6ACTSGCMA1PPME1KLKB1
SCHEMBL3906144 0.82 ALDH1A1 (0.43) ABCB1HPGDABCG2
Hydrochloric Acid SCHEMBL1157165 0.81 CTSG (0.43) KAT6ACTSGCMA1PPME1KLKB1
SCHEMBL1156893 0.80 ALDH1A1 (0.46)
SCHEMBL1156430 0.80 HTR6 (0.41) KAT6ACTSGCMA1PPME1ACLY
SCHEMBL1156390 0.79 ADAMTS4 (0.39) KAT6ACTSGCMA1PPME1KLKB1

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 KAT6A 859/4885CTSG 990/4885CMA1 84/4885
US-10308605-B2 Proton pump inhibitors HRH2, HRH4, HRH1 KAT6A 1091/4885CTSG 905/4885CMA1 70/4885
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 KAT6A 1698/4885CTSG 4513/4885CMA1 895/4885
US-20110028476-A1 PROTON PUMP INHIBITORS HRH2, HRH4, CYP2C19 KAT6A 902/4885CTSG 989/4885CMA1 85/4885

“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.