SCHEMBL6475609

SCHEMBL6475609

Nc1ccccc1C[S+]([O-])c1nc2ccccc2[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 6/20 0.50
ATP4B P51164 6/20 0.50
ALDH1A1 P00352 6/20 0.45
SMN1; SMN2 Q16637 5/20 0.45
KDM4E B2RXH2 4/20 0.45
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
MAPT P10636 4/20 0.45
HPGD P15428 4/20 0.45
HSD17B10 Q99714 4/20 0.45
GAA P10253 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
GLA P06280 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
MASP2 O00187 1/20 0.45
NUDT1 P36639 1/20 0.45
AOC3 Q16853 1/20 0.45
TDP1 Q9NUW8 2/20 0.41
STAT3 P40763 1/20 0.41

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
Water SCHEMBL8401632 0.99 ATP4A (0.49) ATP4AATP4BALDH1A1SMN1; SMN2KDM4E
Water SCHEMBL8401629 0.99 ATP4A (0.49) ATP4AATP4BALDH1A1SMN1; SMN2KDM4E
SCHEMBL9509267 0.87 ATP4A (0.47) ATP4AATP4BALDH1A1SMN1; SMN2KDM4E
SCHEMBL6475069 0.86 ATP4A (0.46) ATP4AATP4BALDH1A1SMN1; SMN2KDM4E
SCHEMBL6474729 0.86 ATP4A (0.55) ATP4AATP4BALDH1A1SMN1; SMN2KDM4E
SCHEMBL6474768 0.86 ATP4A (0.55) ATP4AATP4BALDH1A1SMN1; SMN2KDM4E
SCHEMBL6484515 0.85 CDK1 (0.49) ATP4AATP4BALDH1A1SMN1; SMN2KDM4E
SCHEMBL9509195 0.84 ALDH1A1 (0.50) ATP4AATP4BALDH1A1SMN1; SMN2KDM4E
SCHEMBL10866312 0.84 PKM (0.44) ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A
Water SCHEMBL6481799 0.84 CDK1 (0.48) ATP4AATP4BALDH1A1SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010047038-A1 Method of using (H+/K+) ATPase inhibitors as antiviral agents MOORMAN ALAN E (US) 2001-11-29 US claimed
US-5945425-A ADENOSINE TRIPHOSPHASE INHIBITOR; DNA VIRICIDE G.D. SEARLE & CO. (US) 1999-08-31 US claimed
US-5869513-A ANTIULCER AGENTS G. D. SEARLE & CO. (US) 1999-02-09 US claimed
WO-1995029897-A1 METHOD OF USING (H+/K+) ATPase INHIBITORS AS ANTIVIRAL AGENTS G.D. SEARLE & CO. (US) 1995-11-09 WO claimed
EP-0174717-B1 BENZIMIDAZOLES, AND THEIR PRODUCTION FORMULATION AND USE AS GASTRIC ACID SECRETION INHIBITORS FISONS plc (GB) 1992-01-22 EP claimed
EP-0204215-A1 2-[(1H-benzimidazol-2-ylsulfinyl)methyl]-benzenamines G.D. Searle & Co. (US) 1986-12-10 EP claimed
EP-0174717-A1 Benzimidazoles, and their production formulation and use as gastric acid secretion inhibitors FISONS plc (GB) 1986-03-19 EP claimed
JP-3223261-A None JP disclosed
US-6906078-B2 Method of using (H+/K+) ATPase inhibitors as antiviral agents PHARMACIA CORPORATION (US) 2005-06-14 US disclosed
US-20010047038-A1 Method of using (H+/K+) ATPase inhibitors as antiviral agents MOORMAN ALAN E (US) 2001-11-29 US disclosed
US-5945425-A ADENOSINE TRIPHOSPHASE INHIBITOR; DNA VIRICIDE G.D. SEARLE & CO. (US) 1999-08-31 US disclosed
WO-1995029897-A1 METHOD OF USING (H+/K+) ATPase INHIBITORS AS ANTIVIRAL AGENTS G.D. SEARLE & CO. (US) 1995-11-09 WO disclosed
US-5294439-A Stabilized benzimidazole derivative and composition NIPPON CHEMIPHAR CO., LTD. (JP) 1994-03-15 US disclosed
US-4824856-A Method of protecting gastrointestinal tract NIPPON CHEMIPHAR CO., LTD. (JP) 1989-04-25 US disclosed
EP-0248634-A2 Stabilized benzimidazole derivative and composition NIPPON CHEMIPHAR CO., LTD. (JP) 1987-12-09 EP disclosed
EP-0218336-A2 Use of benzylsulfinylbenzimidazoles as cytoprotective agents for the gastrointestinal tract NIPPON CHEMIPHAR CO., LTD. (JP) 1987-04-15 EP disclosed
EP-0213474-A2 Substituted toluidines, process for their preparation, pharmaceutical compositions containing them and their use as gastric secretion inhibitors HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-11 EP disclosed
EP-0204215-A1 2-[(1H-benzimidazol-2-ylsulfinyl)methyl]-benzenamines G.D. Searle & Co. (US) 1986-12-10 EP disclosed
EP-0204215-A1 2-[(1H-benzimidazol-2-ylsulfinyl)methyl]-benzenamines G.D. Searle & Co. (US) 1986-12-10 EP disclosed
EP-0174717-A1 Benzimidazoles, and their production formulation and use as gastric acid secretion inhibitors FISONS plc (GB) 1986-03-19 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 (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-20010047038-A1 Method of using (H+/K+) ATPase inhibitors as antiviral agents ATP4A, ATP1A1, ATP1A4 ATP4A 1/4885ATP4B 8/4885ALDH1A1 2148/4885

“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.