SCHEMBL6038501

SCHEMBL6038501

COc1ccc(COc2nc(Br)cnc2NS(=O)(=O)c2ccc(Cl)cc2)cc1OC

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 16/20 0.70
MAPT P10636 2/20 0.50
ALDH1A1 P00352 1/20 0.50
TP53 P04637 1/20 0.48
CCR5 P51681 1/20 0.48
MEN1 O00255 1/20 0.44
KMT2A Q03164 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
SCHEMBL6038499 0.91 CCR4 (0.82) CCR4CCR5
SCHEMBL6038687 0.90 CCR4 (0.70) CCR4ALDH1A1CCR5MEN1KMT2A
SCHEMBL6039304 0.90 CCR4 (0.69) CCR4CCR5
SCHEMBL6038727 0.85 CCR4 (0.69) CCR4ALDH1A1CCR5MEN1KMT2A
SCHEMBL6038821 0.85 CCR4 (0.68) CCR4
SCHEMBL6039258 0.84 CCR4 (0.62) CCR4MEN1KMT2A
SCHEMBL6038859 0.82 CCR4 (1.00) CCR4CCR5
SCHEMBL6038846 0.82 CCR4 (1.00) CCR4CCR5
SCHEMBL1731237 0.82 CCR4 (1.00) CCR4CCR5
SCHEMBL6039057 0.82 CCR4 (0.61) CCR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060004010-A1 Ccr4 antagonist and medical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2006-01-05 US disclosed
EP-1541563-A1 CCR4 ANTAGONIST AND MEDICINAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2005-06-15 EP 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-20060004010-A1 Ccr4 antagonist and medical use thereof CCR4, CCR1, CCR9 CCR4 1/4885MAPT 3473/4885ALDH1A1 2902/4885

“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.