SCHEMBL6011545

SCHEMBL6011545

CS(=O)(=O)c1ccc(S(=O)(=O)CCC2CCN(CC[C@H](N)c3ccccc3)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.49
CCR5 P51681 18/20 0.47

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
SCHEMBL6011546 1.00 CCR2 (0.49) CCR2CCR5
SCHEMBL6475214 0.87 CCR5 (0.47) CCR2CCR5
SCHEMBL6011565 0.87 CCR2 (0.49) CCR2CCR5
SCHEMBL6011420 0.87 SLC6A4 (0.54) CCR2CCR5
SCHEMBL6011465 0.82 CCR5 (0.61) CCR2CCR5
SCHEMBL3303563 0.78 CCR5 (0.59) CCR5
SCHEMBL6011459 0.77 SIGMAR1 (0.52)
SCHEMBL6011353 0.77 SLC6A3 (0.47) CCR5
SCHEMBL6011652 0.77 SLC6A4 (0.62) CCR5
SCHEMBL5915317 0.77 CCR2 (0.57) CCR2CCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060189650-A1 Novel piperidine derivatives as modulators of chemokine receptor ccr5 ASTRAZENECA AB (SE) 2006-08-24 US disclosed
EP-1572650-A1 NOVEL PIPERIDINE DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR CCR5 AstraZeneca AB (SE) 2005-09-14 EP disclosed
WO-2004056773-A1 NOVEL PIPERIDINE DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR CCR5 ASTRAZENECA AB (SE) 2004-07-08 WO 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-20060189650-A1 Novel piperidine derivatives as modulators of chemokine receptor ccr5 CCR5, CCR2, CCR1 CCR2 2/4885CCR5 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.