SCHEMBL1156685

SCHEMBL1156685

CCOC(=O)c1cc(-c2ccccc2)n(S(=O)(=O)c2ccc(F)cc2C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 4/20 0.49
GAA P10253 2/20 0.44
ALDH1A1 P00352 3/20 0.42
TSHR P16473 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 2/20 0.40
NOD2 Q9HC29 1/20 0.40
NOD1 Q9Y239 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
GLA P06280 1/20 0.39
KMT2A Q03164 1/20 0.39
GRM4 Q14833 1/20 0.39
CA9 Q16790 1/20 0.38
LMNA P02545 2/20 0.38
PKM P14618 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL1156647 0.88 ALDH1A1 (0.46) CHRNA7GAAALDH1A1TSHRSMN1; SMN2
SCHEMBL1156542 0.84 CHRNA7 (0.60) CHRNA7GAAALDH1A1TSHRSMN1; SMN2
SCHEMBL1156451 0.80 CHRNA7 (0.66) CHRNA7TSHRSMN1; SMN2NPSR1NOD2
SCHEMBL1278264 0.80 JMJD6 (0.43) CHRNA7GAAALDH1A1TSHRSMN1; SMN2
SCHEMBL1156322 0.79 NOD2 (0.50) CHRNA7GAAALDH1A1TSHRSMN1; SMN2
SCHEMBL1278233 0.77 ALDH1A1 (0.41) CHRNA7GAAALDH1A1TSHRSMN1; SMN2
SCHEMBL1156309 0.77 CHRNA7 (0.49) CHRNA7ALDH1A1TSHRSMN1; SMN2HPGD
SCHEMBL1156709 0.77 PKM (0.47) CHRNA7GAAALDH1A1TSHRSMN1; SMN2
SCHEMBL1155963 0.77 TP53 (0.48) CHRNA7GAAALDH1A1TSHRSMN1; SMN2
SCHEMBL1156178 0.77 CHRNA7 (0.44) CHRNA7GAAALDH1A1TSHRSMN1; 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 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 CHRNA7 3394/4885GAA 343/4885ALDH1A1 2529/4885
US-10308605-B2 Proton pump inhibitors HRH2, HRH4, HRH1 CHRNA7 3439/4885GAA 366/4885ALDH1A1 2593/4885
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 CHRNA7 3379/4885GAA 4293/4885ALDH1A1 1764/4885
US-20110028476-A1 PROTON PUMP INHIBITORS HRH2, HRH4, CYP2C19 CHRNA7 3312/4885GAA 334/4885ALDH1A1 2505/4885

“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.