SCHEMBL5405648

SCHEMBL5405648

O=C(c1ccccc1)N1CCC(N2CCC(S(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 4/20 0.55
L3MBTL1 Q9Y468 3/20 0.55
CCR3 P51677 10/20 0.54
HRH1 P35367 7/20 0.54
SPR P35270 1/20 0.53
MBTD1 Q05BQ5 1/20 0.51
KCNH2 Q12809 1/20 0.48
ACACB O00763 2/20 0.48
ACACA Q13085 2/20 0.48
CHRM2 P08172 1/20 0.48
KDM4E B2RXH2 2/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
POLB P06746 1/20 0.46

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
SCHEMBL5398564 0.89 CCR3 (0.57) L3MBTL3L3MBTL1CCR3HRH1MBTD1
SCHEMBL5419347 0.79 STS (0.49) CCR3HRH1KCNH2KDM4ESMN1; SMN2
SCHEMBL5411458 0.77 HRH1 (0.84) CCR3HRH1KCNH2KMT2A
SCHEMBL18840737 0.77 CCR3 (0.80) L3MBTL3L3MBTL1CCR3HRH1CHRM2
SCHEMBL5405007 0.77 KDM2B (0.43) CCR3HRH1KCNH2CHRM2KMT2A
SCHEMBL1806612 0.76 CA12 (0.62) SPRKMT2APOLB
SCHEMBL27669216 0.73 L3MBTL3 (0.94) L3MBTL3L3MBTL1MBTD1KDM4EKMT2A
SCHEMBL10293557 0.73 L3MBTL3 (1.00) L3MBTL3L3MBTL1MBTD1KDM4EKMT2A
SCHEMBL9447404 0.71 ACHE (0.51) SPR
SCHEMBL5457332 0.71 LRRK2 (0.79) L3MBTL3L3MBTL1MBTD1KDM4EKMT2A

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 L3MBTL3 3352/4885L3MBTL1 3977/4885CCR3 1/4885
US-20050171092-A1 Chemical compounds CCR3, CCR1, CCR4 L3MBTL3 3148/4885L3MBTL1 4086/4885CCR3 1/4885
US-20040006080-A1 Chemical compounds CCR3, CCR1, CCR4 L3MBTL3 3352/4885L3MBTL1 3977/4885CCR3 1/4885
US-20040014783-A1 Chemical compounds CCR3, CCR1, CCR4 L3MBTL3 3352/4885L3MBTL1 3977/4885CCR3 1/4885
US-20070179297-A1 Chemical compounds CCR3, CCR1, CCR4 L3MBTL3 3148/4885L3MBTL1 4086/4885CCR3 1/4885

“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.