SCHEMBL5419347

SCHEMBL5419347

CC(C)(C)OC(=O)N1CCC(N2CCC(S(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
STS P08842 7/20 0.49
NAMPT P43490 1/20 0.47
GPR119 Q8TDV5 4/20 0.46
HRH1 P35367 6/20 0.46
CCR3 P51677 6/20 0.46
KCNH2 Q12809 3/20 0.46
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL3209950 0.94 STS (0.55) STSNAMPTGPR119
SCHEMBL2796623 0.81 STS (0.67) STSNAMPTGPR119
SCHEMBL14370267 0.81 NAMPT (0.48) STSNAMPTGPR119KDM4EALDH1A1
SCHEMBL7018366 0.80 STS (0.57) STSNAMPTGPR119
SCHEMBL16771053 0.80 STS (0.69) STSNAMPTGPR119KDM4E
SCHEMBL5398564 0.79 CCR3 (0.57) HRH1CCR3
SCHEMBL4720822 0.79 HRH1 (0.62) GPR119HRH1CCR3KCNH2
SCHEMBL6880661 0.79 NAMPT (0.48) STSNAMPTGPR119
SCHEMBL18703633 0.78 GPR119 (0.56) STSNAMPTGPR119
SCHEMBL23546383 0.77 GPR119 (0.60) STSNAMPTGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070179297-A1 Chemical compounds ASTRAZENECA AB, A SWEDEN CORPORATION 2007-08-02 US disclosed
US-7238811-B2 Chemical compounds ASTRAZENECA AB (SE) 2007-07-03 US disclosed
US-7179922-B2 4-Phenyloxypiperidionopiperidine compounds as antiinflammatory agents; autoimmune diseases; rheumatic diseases; cardiovascular disorders ASTRAZENECA AB (SE) 2007-02-20 US disclosed
US-20050171092-A1 Chemical compounds ASTRAZENECA AB, A SWEDEN CORPORATION 2005-08-04 US disclosed
EP-1274701-B1 [1,4']-BIPIPERIDINE COMPOUNDS ASTRAZENECA AB (SE) 2005-06-29 EP disclosed
US-6903115-B2 Bipiperidine compounds ASTRAZENECA AB (SE) 2005-06-07 US disclosed
EP-1493743-A1 Substituted bipiperidine intermediates and derivatives thereof AstraZeneca AB (SE) 2005-01-05 EP disclosed
US-20040014783-A1 Chemical compounds ASTRAZENECA AB, A SWEDEN CORPORATION 2004-01-22 US disclosed
US-20040006080-A1 Chemical compounds ASTRAZENECA AB, A SWEDEN CORPORATION 2004-01-08 US disclosed
US-6525070-B2 For therapy of chemokine (such as CCR3) or H1 mediated disease state ASTRAZENECA AB (SE) 2003-02-25 US disclosed
US-20020077337-A1 Chemical compounds ASTRAZENECA AB (SE) 2002-06-20 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 (5 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-20020077337-A1 Chemical compounds CCR3, CCR1, CCR4 STS 3717/4885NAMPT 2296/4885GPR119 1917/4885
US-20050171092-A1 Chemical compounds CCR3, CCR1, CCR4 STS 3621/4885NAMPT 1953/4885GPR119 2100/4885
US-20040006080-A1 Chemical compounds CCR3, CCR1, CCR4 STS 3717/4885NAMPT 2296/4885GPR119 1917/4885
US-20040014783-A1 Chemical compounds CCR3, CCR1, CCR4 STS 3717/4885NAMPT 2296/4885GPR119 1917/4885
US-20070179297-A1 Chemical compounds CCR3, CCR1, CCR4 STS 3621/4885NAMPT 1953/4885GPR119 2100/4885

“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.