SCHEMBL6038706

SCHEMBL6038706

Cc1nc(-c2ccc(S(=O)(=O)Nc3ncc(Br)nc3OCc3ccccc3)s2)cs1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 9/20 0.52
KDM4E B2RXH2 5/20 0.50
CCR5 P51681 1/20 0.49
PKM P14618 1/20 0.48
PRNP P04156 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
PFKFB3 Q16875 2/20 0.46
PFKFB4 Q16877 1/20 0.46
POLB P06746 1/20 0.46
EDNRA P25101 1/20 0.43
CCKBR P32239 1/20 0.43
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL6038793 0.85 CCR4 (0.53) CCR4CCR5RXFP1PFKFB3EDNRA
SCHEMBL6038600 0.84 CCR4 (0.60) CCR4CCR5EDNRAALDH1A1MAPK1
SCHEMBL6038701 0.83 CCR4 (0.51) CCR4CCR5PFKFB3EDNRA
SCHEMBL6039005 0.82 CCR4 (0.73) CCR4CCR5EDNRA
SCHEMBL6038947 0.82 GABRA1 (0.52) CCR4CCR5PFKFB3PFKFB4EDNRA
SCHEMBL6038513 0.80 CCR4 (0.50) CCR4CCR5EDNRA
SCHEMBL6038955 0.80 CCR4 (0.50) CCR4CCR5PFKFB3EDNRA
SCHEMBL6039417 0.80 CCR4 (0.54) CCR4CCR5PFKFB3EDNRA
SCHEMBL6038672 0.79 CCR4 (0.71) CCR4KDM4ECCR5POLBEDNRA
SCHEMBL6038588 0.78 CCR4 (0.51) CCR4CCR5EDNRA

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 1/4885KDM4E 3561/4885CCR5 12/4885

“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.