SCHEMBL5398564

SCHEMBL5398564

CS(=O)(=O)c1ccc(C(=O)N2CCC(N3CCC(S(=O)(=O)c4ccc(Cl)c(Cl)c4)CC3)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 7/20 0.57
HRH1 P35367 5/20 0.57
L3MBTL3 Q96JM7 9/20 0.52
L3MBTL1 Q9Y468 7/20 0.52
MBTD1 Q05BQ5 5/20 0.52
HRH3 Q9Y5N1 1/20 0.48
TP53BP1 Q12888 1/20 0.47
L3MBTL4 Q8NA19 1/20 0.47
LRRK2 Q5S007 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 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
SCHEMBL5405648 0.89 L3MBTL3 (0.55) CCR3HRH1L3MBTL3L3MBTL1MBTD1
SCHEMBL5419347 0.79 STS (0.49) CCR3HRH1
SCHEMBL180485 0.76 CCR3 (0.80) CCR3HRH1L3MBTL3L3MBTL1MBTD1
SCHEMBL5405007 0.75 KDM2B (0.43) CCR3HRH1
SCHEMBL1806612 0.74 CA12 (0.62) CA12CA1CA2CA9
SCHEMBL5409041 0.73 HRH1 (1.00) CCR3HRH1HRH3
SCHEMBL5457332 0.72 LRRK2 (0.79) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL1807274 0.72 MGLL (0.64) CA12CA1CA2CA9
SCHEMBL3209950 0.71 STS (0.55)
Acetic Acid SCHEMBL4718930 0.71 HRH1 (0.95) CCR3HRH1HRH3

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 CCR3 1/4885HRH1 39/4885L3MBTL3 3352/4885
US-20050171092-A1 Chemical compounds CCR3, CCR1, CCR4 CCR3 1/4885HRH1 38/4885L3MBTL3 3148/4885
US-20040006080-A1 Chemical compounds CCR3, CCR1, CCR4 CCR3 1/4885HRH1 39/4885L3MBTL3 3352/4885
US-20040014783-A1 Chemical compounds CCR3, CCR1, CCR4 CCR3 1/4885HRH1 39/4885L3MBTL3 3352/4885
US-20070179297-A1 Chemical compounds CCR3, CCR1, CCR4 CCR3 1/4885HRH1 38/4885L3MBTL3 3148/4885

“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.