SCHEMBL2355545

SCHEMBL2355545

Cc1ccc(S(=O)(=O)N2CCc3c([nH]n(Cc4ccccn4)c3=O)C2)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
KDM4E B2RXH2 2/20 0.52
POLB P06746 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.44
GRM5 P41594 1/20 0.43
PKM P14618 1/20 0.41
CD4 P01730 7/20 0.41
GAA P10253 1/20 0.40
GSK3B P49841 1/20 0.39
HSD11B1 P28845 1/20 0.39
NR3C1 P04150 1/20 0.39

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
SCHEMBL2346588 0.85 CD4 (0.51) ALDH1A1SMN1; SMN2PKMCD4GAA
SCHEMBL2358075 0.83 CD4 (0.41) POLBSMN1; SMN2PKMCD4
SCHEMBL2358103 0.82 NPC1 (0.39) ALDH1A1KDM4ESMN1; SMN2CD4GAA
SCHEMBL2355656 0.82 CYP3A4 (0.46) ALDH1A1KDM4EPKMCD4
SCHEMBL6910957 0.81 SLC11A2 (0.48) ALDH1A1KDM4EPOLBGRM5CD4
SCHEMBL2358544 0.80 TP53 (0.41) ALDH1A1PKMCD4GAAHSD11B1
SCHEMBL2357867 0.79 GAA (0.46) ALDH1A1POLBSMN1; SMN2PKMCD4
SCHEMBL2356115 0.77 MEN1 (0.46) ALDH1A1KDM4EPKMCD4NR3C1
SCHEMBL6909864 0.77 CD4 (0.43) ALDH1A1POLBSMN1; SMN2PKMCD4
SCHEMBL2355875 0.76 ALDH1A1 (0.45) ALDH1A1KDM4ESMN1; SMN2CD4GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8748456-B2 Pyrazolo piperidine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2014-06-10 US claimed
EP-2536721-A1 PYRAZOLO PIPERIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GenKyoTex SA (CH) 2012-12-26 EP claimed
US-20120316380-A1 Pyrazolo Piperidine Derivatives as NADPH Oxidase Inhibitors GENKYOTEX SA (CH) 2012-12-13 US claimed
WO-2011101805-A1 PYRAZOLO PIPERIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYOTEX SA (CH) 2011-08-25 WO claimed
US-8748456-B2 Pyrazolo piperidine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2014-06-10 US disclosed
US-8748456-B2 Pyrazolo piperidine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2014-06-10 US disclosed
US-8748456-B2 Pyrazolo piperidine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2014-06-10 US disclosed
US-20120316380-A1 Pyrazolo Piperidine Derivatives as NADPH Oxidase Inhibitors GENKYOTEX SA (CH) 2012-12-13 US disclosed
US-20120316380-A1 Pyrazolo Piperidine Derivatives as NADPH Oxidase Inhibitors GENKYOTEX SA (CH) 2012-12-13 US disclosed
US-20120316380-A1 Pyrazolo Piperidine Derivatives as NADPH Oxidase Inhibitors GENKYOTEX SA (CH) 2012-12-13 US 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-20120316380-A1 Pyrazolo Piperidine Derivatives as NADPH Oxidase Inhibitors NOX1, NOX4, NOX5 ALDH1A1 109/4885KDM4E 3277/4885POLB 370/4885

“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.