SCHEMBL6038439

SCHEMBL6038439

CCN(CC)CC.COc1ccc(COc2nc(C)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OCCN(C)CCN(C)C

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 1/20 0.72
KCNH2 Q12809 1/20 0.36
EDNRA P25101 9/20 0.35
KMT2A Q03164 1/20 0.34
TSHR P16473 1/20 0.34
KDM4E B2RXH2 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL6039019 0.93 CCR4 (0.84) CCR4KCNH2EDNRA
SCHEMBL6039055 0.92 CCR4 (0.71) CCR4EDNRAKMT2ATSHRSMN1; SMN2
SCHEMBL6039078 0.91 CCR4 (0.84) CCR4EDNRAKMT2ATSHR
SCHEMBL6038969 0.90 CCR4 (0.65) CCR4KCNH2EDNRAKMT2A
SCHEMBL6038409 0.85 CCR4 (0.71) CCR4EDNRATSHR
SCHEMBL6038552 0.84 CCR4 (0.85) CCR4EDNRAKMT2A
SCHEMBL6038637 0.84 CCR4 (0.68) CCR4EDNRAKMT2ATSHRSMN1; SMN2
SCHEMBL6038846 0.84 CCR4 (1.00) CCR4EDNRA
SCHEMBL6038859 0.84 CCR4 (1.00) CCR4EDNRA
SCHEMBL6038838 0.83 CCR4 (0.98) CCR4EDNRA

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 1/4885KCNH2 3566/4885EDNRA 512/4885

“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.